CAS RN: 52277-73-3
CAS Name: cobalt(3+); 4-[[3-(dioxidoamino)-6-oxo-1-cyclohexa-2,4-dienylidene]hydrazinylidene]-5-methyl-2-phenyl-3-pyrazolone; hydron; 1-(5-nitro-2-oxidophenyl)azo-2-naphthalenolate
OPENEYE Name: cobaltic; 4-[[3-(dioxidoamino)-6-oxo-cyclohexa-2,4-dien-1-ylidene]hydrazono]-5-methyl-2-phenyl-pyrazol-3-one; hydron; 1-(5-nitro-2-oxido-phenyl)azonaphthalen-2-olate
IUPAC Name: cobalt(3+); 4-[[3-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenylpyrazol-3-one; hydron; 1-[(5-nitro-2-oxidophenyl)diazenyl]naphthalen-2-olate
SYSTEMATIC NAME: 4-[[3-[bis(oxidanidyl)amino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenyl-pyrazol-3-one; cobalt(3+); hydron; 1-[(5-nitro-2-oxidanidyl-phenyl)diazenyl]naphthalen-2-olate
MOLECULAR FORMULA: C32H21CoN8O8
MOLECULAR WEIGHT: 704.49114
SMILES: [H+].CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)[N+](=O)[O-])[O-])[O-].[Co+3]
Structure:
CAS RN: 52277-69-7
CAS Name: cobalt(3+); 1-[[3-(dioxidoamino)-6-oxo-1-cyclohexa-2,4-dienylidene]hydrazinylidene]-2-naphthalenone; hydron; 1-(5-nitro-2-oxidophenyl)azo-2-naphthalenolate
OPENEYE Name: cobaltic; 1-[[3-(dioxidoamino)-6-oxo-cyclohexa-2,4-dien-1-ylidene]hydrazono]naphthalen-2-one; hydron; 1-(5-nitro-2-oxido-phenyl)azonaphthalen-2-olate
IUPAC Name: cobalt(3+); 1-[[3-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]naphthalen-2-one; hydron; 1-[(5-nitro-2-oxidophenyl)diazenyl]naphthalen-2-olate
SYSTEMATIC NAME: 1-[[3-[bis(oxidanidyl)amino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]hydrazinylidene]naphthalen-2-one; cobalt(3+); hydron; 1-[(5-nitro-2-oxidanidyl-phenyl)diazenyl]naphthalen-2-olate
MOLECULAR FORMULA: C32H19CoN6O8
MOLECULAR WEIGHT: 674.46186
SMILES: [H+].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)[N+](=O)[O-])[O-])[O-].C1=CC=C2C(=C1)C=CC(=O)C2=NN=C3C=C(C=CC3=O)N([O-])[O-].[Co+3]
Structure:
CAS RN: 27193-86-8
CAS Name: 2-dodecylphenol
OPENEYE Name: 2-dodecylphenol
IUPAC Name: 2-dodecylphenol
SYSTEMATIC NAME: 2-dodecylphenol
MOLECULAR FORMULA: C18H30O
MOLECULAR WEIGHT: 262.4302
SMILES: CCCCCCCCCCCCC1=CC=CC=C1O
Structure:
CAS RN: 108528-41-2
CAS Name: calcium 2-dodecylphenolate
OPENEYE Name: calcium 2-dodecylphenolate
IUPAC Name: calcium 2-dodecylphenolate
SYSTEMATIC NAME: calcium 2-dodecylphenolate
MOLECULAR FORMULA: C36H58CaO2
MOLECULAR WEIGHT: 562.92252
SMILES: CCCCCCCCCCCCC1=CC=CC=C1[O-].CCCCCCCCCCCCC1=CC=CC=C1[O-].[Ca+2]
Structure:
CAS RN: 52274-73-4
CAS Name: calcium 2-dodecylphenolate
OPENEYE Name: calcium 2-dodecylphenolate
IUPAC Name: calcium 2-dodecylphenolate
SYSTEMATIC NAME: calcium 2-dodecylphenolate
MOLECULAR FORMULA: C36H58CaO2
MOLECULAR WEIGHT: 562.92252
SMILES: CCCCCCCCCCCCC1=CC=CC=C1[O-].CCCCCCCCCCCCC1=CC=CC=C1[O-].[Ca+2]
Structure:
CAS RN: 139989-39-2
CAS Name: butane-1,4-diol; 1,6-diisocyanatohexane; hexanedioic acid; hexane-1,6-diol
OPENEYE Name: adipic acid; butane-1,4-diol; 1,6-diisocyanatohexane; hexane-1,6-diol
IUPAC Name: butane-1,4-diol; 1,6-diisocyanatohexane; hexanedioic acid; hexane-1,6-diol
SYSTEMATIC NAME: butane-1,4-diol; 1,6-diisocyanatohexane; hexanedioic acid; hexane-1,6-diol
MOLECULAR FORMULA: C24H46N2O10
MOLECULAR WEIGHT: 522.62944
SMILES: C(CCCN=C=O)CCN=C=O.C(CCCO)CCO.C(CCC(=O)O)CC(=O)O.C(CCO)CO
Structure:
CAS RN: 52270-22-1
CAS Name: butane-1,4-diol; 1,6-diisocyanatohexane; hexanedioic acid; hexane-1,6-diol
OPENEYE Name: adipic acid; butane-1,4-diol; 1,6-diisocyanatohexane; hexane-1,6-diol
IUPAC Name: butane-1,4-diol; 1,6-diisocyanatohexane; hexanedioic acid; hexane-1,6-diol
SYSTEMATIC NAME: butane-1,4-diol; 1,6-diisocyanatohexane; hexanedioic acid; hexane-1,6-diol
MOLECULAR FORMULA: C24H46N2O10
MOLECULAR WEIGHT: 522.62944
SMILES: C(CCCN=C=O)CCN=C=O.C(CCCO)CCO.C(CCC(=O)O)CC(=O)O.C(CCO)CO
Structure:
CAS RN: 52257-07-5
CAS Name: 2-azepanone; decanedioic acid; dodecanedioic acid; hexane-1,6-diamine
OPENEYE Name: azepan-2-one; decanedioic acid; dodecanedioic acid; hexane-1,6-diamine
IUPAC Name: azepan-2-one; decanedioic acid; dodecanedioic acid; hexane-1,6-diamine
SYSTEMATIC NAME: azepan-2-one; decanedioic acid; dodecanedioic acid; hexane-1,6-diamine
MOLECULAR FORMULA: C34H67N3O9
MOLECULAR WEIGHT: 661.91048
SMILES: C1CCC(=O)NCC1.C(CCCCCC(=O)O)CCCCC(=O)O.C(CCCCC(=O)O)CCCC(=O)O.C(CCCN)CCN
Structure:
CAS RN: 52256-40-3
CAS Name: chromium(3+); hydron; 5-methyl-4-(2-oxido-5-sulfamoylphenyl)azo-2-phenyl-3-pyrazololate; 1-(2-oxido-5-sulfamoylphenyl)azo-2-naphthalenolate
OPENEYE Name: chromic; hydron; 5-methyl-4-(2-oxido-5-sulfamoyl-phenyl)azo-2-phenyl-pyrazol-3-olate; 1-(2-oxido-5-sulfamoyl-phenyl)azonaphthalen-2-olate
IUPAC Name: chromium(3+); hydron; 5-methyl-4-[(2-oxido-5-sulfamoylphenyl)diazenyl]-2-phenylpyrazol-3-olate; 1-[(2-oxido-5-sulfamoylphenyl)diazenyl]naphthalen-2-olate
SYSTEMATIC NAME: chromium(3+); hydron; 5-methyl-4-[(2-oxidanidyl-5-sulfamoyl-phenyl)diazenyl]-2-phenyl-pyrazol-3-olate; 1-[(2-oxidanidyl-5-sulfamoyl-phenyl)diazenyl]naphthalen-2-olate
MOLECULAR FORMULA: C32H25CrN8O8S2
MOLECULAR WEIGHT: 765.7158
SMILES: [H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=CC=C3.C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)S(=O)(=O)N)[O-])[O-].[Cr+3]
Structure:
CAS RN: 52256-39-0
CAS Name: cobalt(3+); 4-[[3-(dioxidoamino)-6-oxo-1-cyclohexa-2,4-dienylidene]hydrazinylidene]-5-methyl-2-phenyl-3-pyrazolone; hydron; 2-[(3-methyl-5-oxido-1-phenyl-4-pyrazolyl)azo]benzoate
OPENEYE Name: cobaltic; 4-[[3-(dioxidoamino)-6-oxo-cyclohexa-2,4-dien-1-ylidene]hydrazono]-5-methyl-2-phenyl-pyrazol-3-one; hydron; 2-(3-methyl-5-oxido-1-phenyl-pyrazol-4-yl)azobenzoate
IUPAC Name: cobalt(3+); 4-[[3-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenylpyrazol-3-one; hydron; 2-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]benzoate
SYSTEMATIC NAME: 4-[[3-[bis(oxidanidyl)amino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenyl-pyrazol-3-one; cobalt(3+); hydron; 2-[(3-methyl-5-oxidanidyl-1-phenyl-pyrazol-4-yl)diazenyl]benzoate
MOLECULAR FORMULA: C33H24CoN9O7
MOLECULAR WEIGHT: 717.53296
SMILES: [H+].CC1=NN(C(=C1N=NC2=CC=CC=C2C(=O)[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.[Co+3]
Structure:
CAS RN: 74411-38-4
CAS Name: cobalt(3+); 4-[[3-(dioxidoamino)-6-oxo-1-cyclohexa-2,4-dienylidene]hydrazinylidene]-5-methyl-2-phenyl-3-pyrazolone; hydron; 2-[(3-methyl-5-oxido-1-phenyl-4-pyrazolyl)azo]benzoate
OPENEYE Name: cobaltic; 4-[[3-(dioxidoamino)-6-oxo-cyclohexa-2,4-dien-1-ylidene]hydrazono]-5-methyl-2-phenyl-pyrazol-3-one; hydron; 2-(3-methyl-5-oxido-1-phenyl-pyrazol-4-yl)azobenzoate
IUPAC Name: cobalt(3+); 4-[[3-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenylpyrazol-3-one; hydron; 2-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]benzoate
SYSTEMATIC NAME: 4-[[3-[bis(oxidanidyl)amino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenyl-pyrazol-3-one; cobalt(3+); hydron; 2-[(3-methyl-5-oxidanidyl-1-phenyl-pyrazol-4-yl)diazenyl]benzoate
MOLECULAR FORMULA: C33H24CoN9O7
MOLECULAR WEIGHT: 717.53296
SMILES: [H+].CC1=NN(C(=C1N=NC2=CC=CC=C2C(=O)[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.[Co+3]
Structure:
CAS RN: 461393-61-3
CAS Name: cobalt(3+); 4-[[3-(dioxidoamino)-6-oxo-1-cyclohexa-2,4-dienylidene]hydrazinylidene]-5-methyl-2-phenyl-3-pyrazolone; hydron; 5-methyl-4-(5-nitro-2-oxidophenyl)azo-2-phenyl-3-pyrazololate
OPENEYE Name: cobaltic; 4-[[3-(dioxidoamino)-6-oxo-cyclohexa-2,4-dien-1-ylidene]hydrazono]-5-methyl-2-phenyl-pyrazol-3-one; hydron; 5-methyl-4-(5-nitro-2-oxido-phenyl)azo-2-phenyl-pyrazol-3-olate
IUPAC Name: cobalt(3+); 4-[[3-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenylpyrazol-3-one; hydron; 5-methyl-4-[(5-nitro-2-oxidophenyl)diazenyl]-2-phenylpyrazol-3-olate
SYSTEMATIC NAME: 4-[[3-[bis(oxidanidyl)amino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenyl-pyrazol-3-one; cobalt(3+); hydron; 5-methyl-4-[(5-nitro-2-oxidanidyl-phenyl)diazenyl]-2-phenyl-pyrazol-3-olate
MOLECULAR FORMULA: C32H23CoN10O8
MOLECULAR WEIGHT: 734.52042
SMILES: [H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.[Co+3]
Structure:
CAS RN: 52256-38-9
CAS Name: cobalt(3+); 4-[[3-(dioxidoamino)-6-oxo-1-cyclohexa-2,4-dienylidene]hydrazinylidene]-5-methyl-2-phenyl-3-pyrazolone; hydron; 5-methyl-4-(5-nitro-2-oxidophenyl)azo-2-phenyl-3-pyrazololate
OPENEYE Name: cobaltic; 4-[[3-(dioxidoamino)-6-oxo-cyclohexa-2,4-dien-1-ylidene]hydrazono]-5-methyl-2-phenyl-pyrazol-3-one; hydron; 5-methyl-4-(5-nitro-2-oxido-phenyl)azo-2-phenyl-pyrazol-3-olate
IUPAC Name: cobalt(3+); 4-[[3-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenylpyrazol-3-one; hydron; 5-methyl-4-[(5-nitro-2-oxidophenyl)diazenyl]-2-phenylpyrazol-3-olate
SYSTEMATIC NAME: 4-[[3-[bis(oxidanidyl)amino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenyl-pyrazol-3-one; cobalt(3+); hydron; 5-methyl-4-[(5-nitro-2-oxidanidyl-phenyl)diazenyl]-2-phenyl-pyrazol-3-olate
MOLECULAR FORMULA: C32H23CoN10O8
MOLECULAR WEIGHT: 734.52042
SMILES: [H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.[Co+3]
Structure:
CAS RN: 102381-84-0
CAS Name: chromium(3+); 4-[[3-(dioxidoamino)-6-oxo-1-cyclohexa-2,4-dienylidene]hydrazinylidene]-5-methyl-2-phenyl-3-pyrazolone; hydron; 5-methyl-4-(5-nitro-2-oxidophenyl)azo-2-phenyl-3-pyrazololate
OPENEYE Name: chromic; 4-[[3-(dioxidoamino)-6-oxo-cyclohexa-2,4-dien-1-ylidene]hydrazono]-5-methyl-2-phenyl-pyrazol-3-one; hydron; 5-methyl-4-(5-nitro-2-oxido-phenyl)azo-2-phenyl-pyrazol-3-olate
IUPAC Name: chromium(3+); 4-[[3-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenylpyrazol-3-one; hydron; 5-methyl-4-[(5-nitro-2-oxidophenyl)diazenyl]-2-phenylpyrazol-3-olate
SYSTEMATIC NAME: 4-[[3-[bis(oxidanidyl)amino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenyl-pyrazol-3-one; chromium(3+); hydron; 5-methyl-4-[(5-nitro-2-oxidanidyl-phenyl)diazenyl]-2-phenyl-pyrazol-3-olate
MOLECULAR FORMULA: C32H23CrN10O8
MOLECULAR WEIGHT: 727.58332
SMILES: [H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.[Cr+3]
Structure:
CAS RN: 10279-42-2
CAS Name: chromium(3+); 4-[[3-(dioxidoamino)-6-oxo-1-cyclohexa-2,4-dienylidene]hydrazinylidene]-5-methyl-2-phenyl-3-pyrazolone; hydron; 5-methyl-4-(5-nitro-2-oxidophenyl)azo-2-phenyl-3-pyrazololate
OPENEYE Name: chromic; 4-[[3-(dioxidoamino)-6-oxo-cyclohexa-2,4-dien-1-ylidene]hydrazono]-5-methyl-2-phenyl-pyrazol-3-one; hydron; 5-methyl-4-(5-nitro-2-oxido-phenyl)azo-2-phenyl-pyrazol-3-olate
IUPAC Name: chromium(3+); 4-[[3-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenylpyrazol-3-one; hydron; 5-methyl-4-[(5-nitro-2-oxidophenyl)diazenyl]-2-phenylpyrazol-3-olate
SYSTEMATIC NAME: 4-[[3-[bis(oxidanidyl)amino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenyl-pyrazol-3-one; chromium(3+); hydron; 5-methyl-4-[(5-nitro-2-oxidanidyl-phenyl)diazenyl]-2-phenyl-pyrazol-3-olate
MOLECULAR FORMULA: C32H23CrN10O8
MOLECULAR WEIGHT: 727.58332
SMILES: [H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.[Cr+3]
Structure:
CAS RN: 180262-71-9
CAS Name: chromium(3+); 4-[[3-(dioxidoamino)-6-oxo-1-cyclohexa-2,4-dienylidene]hydrazinylidene]-5-methyl-2-phenyl-3-pyrazolone; hydron; 5-methyl-4-(5-nitro-2-oxidophenyl)azo-2-phenyl-3-pyrazololate
OPENEYE Name: chromic; 4-[[3-(dioxidoamino)-6-oxo-cyclohexa-2,4-dien-1-ylidene]hydrazono]-5-methyl-2-phenyl-pyrazol-3-one; hydron; 5-methyl-4-(5-nitro-2-oxido-phenyl)azo-2-phenyl-pyrazol-3-olate
IUPAC Name: chromium(3+); 4-[[3-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenylpyrazol-3-one; hydron; 5-methyl-4-[(5-nitro-2-oxidophenyl)diazenyl]-2-phenylpyrazol-3-olate
SYSTEMATIC NAME: 4-[[3-[bis(oxidanidyl)amino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenyl-pyrazol-3-one; chromium(3+); hydron; 5-methyl-4-[(5-nitro-2-oxidanidyl-phenyl)diazenyl]-2-phenyl-pyrazol-3-olate
MOLECULAR FORMULA: C32H23CrN10O8
MOLECULAR WEIGHT: 727.58332
SMILES: [H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.[Cr+3]
Structure:
CAS RN: 24328-40-3
CAS Name: chromium(3+); 4-[[3-(dioxidoamino)-6-oxo-1-cyclohexa-2,4-dienylidene]hydrazinylidene]-5-methyl-2-phenyl-3-pyrazolone; hydron; 5-methyl-4-(5-nitro-2-oxidophenyl)azo-2-phenyl-3-pyrazololate
OPENEYE Name: chromic; 4-[[3-(dioxidoamino)-6-oxo-cyclohexa-2,4-dien-1-ylidene]hydrazono]-5-methyl-2-phenyl-pyrazol-3-one; hydron; 5-methyl-4-(5-nitro-2-oxido-phenyl)azo-2-phenyl-pyrazol-3-olate
IUPAC Name: chromium(3+); 4-[[3-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenylpyrazol-3-one; hydron; 5-methyl-4-[(5-nitro-2-oxidophenyl)diazenyl]-2-phenylpyrazol-3-olate
SYSTEMATIC NAME: 4-[[3-[bis(oxidanidyl)amino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenyl-pyrazol-3-one; chromium(3+); hydron; 5-methyl-4-[(5-nitro-2-oxidanidyl-phenyl)diazenyl]-2-phenyl-pyrazol-3-olate
MOLECULAR FORMULA: C32H23CrN10O8
MOLECULAR WEIGHT: 727.58332
SMILES: [H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.[Cr+3]
Structure:
CAS RN: 52256-37-8
CAS Name: chromium(3+); 4-[[3-(dioxidoamino)-6-oxo-1-cyclohexa-2,4-dienylidene]hydrazinylidene]-5-methyl-2-phenyl-3-pyrazolone; hydron; 5-methyl-4-(5-nitro-2-oxidophenyl)azo-2-phenyl-3-pyrazololate
OPENEYE Name: chromic; 4-[[3-(dioxidoamino)-6-oxo-cyclohexa-2,4-dien-1-ylidene]hydrazono]-5-methyl-2-phenyl-pyrazol-3-one; hydron; 5-methyl-4-(5-nitro-2-oxido-phenyl)azo-2-phenyl-pyrazol-3-olate
IUPAC Name: chromium(3+); 4-[[3-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenylpyrazol-3-one; hydron; 5-methyl-4-[(5-nitro-2-oxidophenyl)diazenyl]-2-phenylpyrazol-3-olate
SYSTEMATIC NAME: 4-[[3-[bis(oxidanidyl)amino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenyl-pyrazol-3-one; chromium(3+); hydron; 5-methyl-4-[(5-nitro-2-oxidanidyl-phenyl)diazenyl]-2-phenyl-pyrazol-3-olate
MOLECULAR FORMULA: C32H23CrN10O8
MOLECULAR WEIGHT: 727.58332
SMILES: [H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.[Cr+3]
Structure:
CAS RN: 61931-16-6
CAS Name: chromium(3+); 4-[[3-(dioxidoamino)-6-oxo-1-cyclohexa-2,4-dienylidene]hydrazinylidene]-5-methyl-2-phenyl-3-pyrazolone; hydron; 5-methyl-4-(5-nitro-2-oxidophenyl)azo-2-phenyl-3-pyrazololate
OPENEYE Name: chromic; 4-[[3-(dioxidoamino)-6-oxo-cyclohexa-2,4-dien-1-ylidene]hydrazono]-5-methyl-2-phenyl-pyrazol-3-one; hydron; 5-methyl-4-(5-nitro-2-oxido-phenyl)azo-2-phenyl-pyrazol-3-olate
IUPAC Name: chromium(3+); 4-[[3-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenylpyrazol-3-one; hydron; 5-methyl-4-[(5-nitro-2-oxidophenyl)diazenyl]-2-phenylpyrazol-3-olate
SYSTEMATIC NAME: 4-[[3-[bis(oxidanidyl)amino]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenyl-pyrazol-3-one; chromium(3+); hydron; 5-methyl-4-[(5-nitro-2-oxidanidyl-phenyl)diazenyl]-2-phenyl-pyrazol-3-olate
MOLECULAR FORMULA: C32H23CrN10O8
MOLECULAR WEIGHT: 727.58332
SMILES: [H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.[Cr+3]
Structure:
CAS RN: 52247-86-6
CAS Name: (2R,4aS,6aR,6aS,6bR,10S,12aS,14bS)-10-[[(1R,2S)-2-carboxycyclohexyl]-oxomethoxy]-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylic acid
OPENEYE Name: (2R,4aS,6aR,6aS,6bR,10S,12aS,14bS)-10-[(1R,2S)-2-carboxycyclohexanecarbonyl]oxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylic acid
IUPAC Name: (2R,4aS,6aR,6aS,6bR,10S,12aS,14bS)-10-[(1R,2S)-2-carboxycyclohexanecarbonyl]oxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylic acid
SYSTEMATIC NAME: (2R,4aS,6aR,6aS,6bR,10S,12aS,14bS)-10-[(1R,2S)-2-carboxycyclohexyl]carbonyloxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxidanylidene-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylic acid
MOLECULAR FORMULA: C38H56O7
MOLECULAR WEIGHT: 624.84704
SMILES: C[C@]12CC[C@@](C[C@@H]1C3=CC(=O)[C@@H]4[C@]5(CC[C@@H](C(C5CC[C@]4([C@@]3(CC2)C)C)(C)C)OC(=O)[C@@H]6CCCC[C@@H]6C(=O)O)C)(C)C(=O)O
Structure:
CAS RN: 52247-59-3
CAS Name: benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; terephthalic acid
OPENEYE Name: adipic acid; 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; isophthalic acid; terephthalic acid
IUPAC Name: benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; terephthalic acid
SYSTEMATIC NAME: benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; terephthalic acid
MOLECULAR FORMULA: C33H48O17
MOLECULAR WEIGHT: 716.72402
SMILES: CCC(CO)(CO)CO.CC(C)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC=C1C(=O)O)C(=O)O.C(CCC(=O)O)CC(=O)O
Structure:
CAS RN: 52243-33-1
CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 4-methylbenzenesulfonic acid
OPENEYE Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 4-methylbenzenesulfonic acid
IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 4-methylbenzenesulfonic acid
SYSTEMATIC NAME: 2-[bis(2-hydroxyethyl)amino]ethanol; 4-methylbenzenesulfonic acid
MOLECULAR FORMULA: C13H23NO6S
MOLECULAR WEIGHT: 321.38982
SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C(CO)N(CCO)CCO
Structure:
CAS RN: 52234-85-2
CAS Name: trimethyl(tridecan-2-yl)ammonium chloride
OPENEYE Name: trimethyl(1-methyldodecyl)ammonium chloride
IUPAC Name: trimethyl(tridecan-2-yl)azanium chloride
SYSTEMATIC NAME: trimethyl(tridecan-2-yl)azanium chloride
MOLECULAR FORMULA: C16H36ClN
MOLECULAR WEIGHT: 277.91674
SMILES: CCCCCCCCCCCC(C)[N+](C)(C)C.[Cl-]
Structure:
CAS RN: 52232-09-4
CAS Name: 1-hexanol; 2-methyloxirane; oxirane
OPENEYE Name: hexan-1-ol; 2-methyloxirane; oxirane
IUPAC Name: hexan-1-ol; 2-methyloxirane; oxirane
SYSTEMATIC NAME: hexan-1-ol; 2-methyloxirane; oxirane
MOLECULAR FORMULA: C11H24O3
MOLECULAR WEIGHT: 204.30646
SMILES: CCCCCCO.CC1CO1.C1CO1
Structure:
CAS RN: 52224-16-5
CAS Name: 4-amino-2-hydroxybenzoic acid; 8-quinolinol
OPENEYE Name: 4-amino-2-hydroxy-benzoic acid; quinolin-8-ol
IUPAC Name: 4-amino-2-hydroxybenzoic acid; quinolin-8-ol
SYSTEMATIC NAME: 4-azanyl-2-oxidanyl-benzoic acid; quinolin-8-ol
MOLECULAR FORMULA: C16H14N2O4
MOLECULAR WEIGHT: 298.29336
SMILES: C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC(=C(C=C1N)O)C(=O)O
Structure:
CAS RN: 52210-64-7
CAS Name: 8,9-dimethoxy-N-(phenylmethyl)-5,6-dihydroimidazo[5,1-a]isoquinolin-3-amine hydrochloride
OPENEYE Name: N-benzyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinolin-3-amine hydrochloride
IUPAC Name: N-benzyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinolin-3-amine hydrochloride
SYSTEMATIC NAME: 8,9-dimethoxy-N-(phenylmethyl)-5,6-dihydroimidazo[5,1-a]isoquinolin-3-amine hydrochloride
MOLECULAR FORMULA: C20H22ClN3O2
MOLECULAR WEIGHT: 371.86058
SMILES: COC1=C(C=C2C(=C1)CCN3C2=CN=C3NCC4=CC=CC=C4)OC.Cl
Structure:
CAS RN: 65988-73-0
CAS Name: 8,9-dimethoxy-N-(phenylmethyl)-5,6-dihydroimidazo[5,1-a]isoquinolin-3-amine hydrochloride
OPENEYE Name: N-benzyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinolin-3-amine hydrochloride
IUPAC Name: N-benzyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinolin-3-amine hydrochloride
SYSTEMATIC NAME: 8,9-dimethoxy-N-(phenylmethyl)-5,6-dihydroimidazo[5,1-a]isoquinolin-3-amine hydrochloride
MOLECULAR FORMULA: C20H22ClN3O2
MOLECULAR WEIGHT: 371.86058
SMILES: COC1=C(C=C2C(=C1)CCN3C2=CN=C3NCC4=CC=CC=C4)OC.Cl
Structure:
CAS RN: 52207-83-7
CAS Name: prop-2-enylhydrazine hydrochloride
OPENEYE Name: allylhydrazine hydrochloride
IUPAC Name: prop-2-enylhydrazine hydrochloride
SYSTEMATIC NAME: prop-2-enyldiazane hydrochloride
MOLECULAR FORMULA: C3H9ClN2
MOLECULAR WEIGHT: 108.56996
SMILES: C=CCNN.Cl
Structure:
CAS RN: 52201-24-8
CAS Name: 2-(phenylmethoxycarbonylamino)acetic acid [2-(chloromethyl)-4-nitrophenyl] ester
OPENEYE Name: [2-(chloromethyl)-4-nitro-phenyl] 2-(benzyloxycarbonylamino)acetate
IUPAC Name: [2-(chloromethyl)-4-nitrophenyl] 2-(phenylmethoxycarbonylamino)acetate
SYSTEMATIC NAME: [2-(chloromethyl)-4-nitro-phenyl] 2-(phenylmethoxycarbonylamino)ethanoate
MOLECULAR FORMULA: C17H15ClN2O6
MOLECULAR WEIGHT: 378.7638
SMILES: C1=CC=C(C=C1)COC(=O)NCC(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])CCl
Structure:
CAS RN: 119157-64-1
CAS Name: 1-[5-[(2R)-1-methyl-2-piperidinyl]-3,4-dihydro-2H-pyridin-1-yl]ethanone
OPENEYE Name: 1-[5-[(2R)-1-methyl-2-piperidyl]-3,4-dihydro-2H-pyridin-1-yl]ethanone
IUPAC Name: 1-[5-[(2R)-1-methylpiperidin-2-yl]-3,4-dihydro-2H-pyridin-1-yl]ethanone
SYSTEMATIC NAME: 1-[5-[(2R)-1-methylpiperidin-2-yl]-3,4-dihydro-2H-pyridin-1-yl]ethanone
MOLECULAR FORMULA: C13H22N2O
MOLECULAR WEIGHT: 222.32658
SMILES: CC(=O)N1CCCC(=C1)[C@H]2CCCCN2C
Structure:
CAS RN: 52196-10-8
CAS Name: 1-[5-[(2R)-1-methyl-2-piperidinyl]-3,4-dihydro-2H-pyridin-1-yl]ethanone
OPENEYE Name: 1-[5-[(2R)-1-methyl-2-piperidyl]-3,4-dihydro-2H-pyridin-1-yl]ethanone
IUPAC Name: 1-[5-[(2R)-1-methylpiperidin-2-yl]-3,4-dihydro-2H-pyridin-1-yl]ethanone
SYSTEMATIC NAME: 1-[5-[(2R)-1-methylpiperidin-2-yl]-3,4-dihydro-2H-pyridin-1-yl]ethanone
MOLECULAR FORMULA: C13H22N2O
MOLECULAR WEIGHT: 222.32658
SMILES: CC(=O)N1CCCC(=C1)[C@H]2CCCCN2C
Structure:
CAS RN: 52178-87-7
CAS Name: 2-[4-(2,2-difluorocyclopropyl)phenoxy]-2-methylpropanoic acid
OPENEYE Name: 2-[4-(2,2-difluorocyclopropyl)phenoxy]-2-methyl-propanoic acid
IUPAC Name: 2-[4-(2,2-difluorocyclopropyl)phenoxy]-2-methylpropanoic acid
SYSTEMATIC NAME: 2-[4-[2,2-bis(fluoranyl)cyclopropyl]phenoxy]-2-methyl-propanoic acid
MOLECULAR FORMULA: C13H14F2O3
MOLECULAR WEIGHT: 256.245266
SMILES: CC(C)(C(=O)O)OC1=CC=C(C=C1)C2CC2(F)F
Structure:
CAS RN: 52148-45-5
CAS Name: disodium 2,6-dimethyl-3,5-bis(1-oxopropyl)-4H-pyridine-1,4-dicarboxylate
OPENEYE Name: disodium 2,6-dimethyl-3,5-di(propanoyl)-4H-pyridine-1,4-dicarboxylate
IUPAC Name: disodium 2,6-dimethyl-3,5-di(propanoyl)-4H-pyridine-1,4-dicarboxylate
SYSTEMATIC NAME: disodium 2,6-dimethyl-3,5-di(propanoyl)-4H-pyridine-1,4-dicarboxylate
MOLECULAR FORMULA: C15H17NNa2O6
MOLECULAR WEIGHT: 353.27812
SMILES: CCC(=O)C1=C(N(C(=C(C1C(=O)[O-])C(=O)CC)C)C(=O)[O-])C.[Na+].[Na+]
Structure:
CAS RN: 52146-62-0
CAS Name: (1R,2R,6R)-2-hydroxy-4-methyl-7-oxabicyclo[4.1.0]hept-3-en-5-one
OPENEYE Name: (1R,2R,6R)-2-hydroxy-4-methyl-7-oxabicyclo[4.1.0]hept-3-en-5-one
IUPAC Name: (1R,2R,6R)-2-hydroxy-4-methyl-7-oxabicyclo[4.1.0]hept-3-en-5-one
SYSTEMATIC NAME: (1R,2R,6R)-4-methyl-2-oxidanyl-7-oxabicyclo[4.1.0]hept-3-en-5-one
MOLECULAR FORMULA: C7H8O3
MOLECULAR WEIGHT: 140.13662
SMILES: CC1=C[C@H]([C@@H]2[C@H](C1=O)O2)O
Structure:
CAS RN: 52110-05-1
CAS Name: magnesium; dioxido(oxo)silane; zirconium(4+)
OPENEYE Name: magnesium; dioxido(oxo)silane; zirconium(4+)
IUPAC Name: magnesium; dioxido(oxo)silane; zirconium(4+)
SYSTEMATIC NAME: magnesium; bis(oxidanidyl)-oxidanylidene-silane; zirconium(4+)
MOLECULAR FORMULA: MgO9Si3Zr
MOLECULAR WEIGHT: 343.7801
SMILES: [O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Mg+2].[Zr+4]
Structure:
CAS RN: 52096-13-6
CAS Name: 2-amino-4-(5-oxo-2-isoxazolyl)butanoic acid
OPENEYE Name: 2-amino-4-(5-oxoisoxazol-2-yl)butanoic acid
IUPAC Name: 2-amino-4-(5-oxo-1,2-oxazol-2-yl)butanoic acid
SYSTEMATIC NAME: 2-azanyl-4-(5-oxidanylidene-1,2-oxazol-2-yl)butanoic acid
MOLECULAR FORMULA: C7H10N2O4
MOLECULAR WEIGHT: 186.1653
SMILES: C1=CN(OC1=O)CCC(C(=O)O)N
Structure:
CAS RN: 60102-46-7
CAS Name: 2-amino-4-(5-oxo-2-isoxazolyl)butanoic acid
OPENEYE Name: 2-amino-4-(5-oxoisoxazol-2-yl)butanoic acid
IUPAC Name: 2-amino-4-(5-oxo-1,2-oxazol-2-yl)butanoic acid
SYSTEMATIC NAME: 2-azanyl-4-(5-oxidanylidene-1,2-oxazol-2-yl)butanoic acid
MOLECULAR FORMULA: C7H10N2O4
MOLECULAR WEIGHT: 186.1653
SMILES: C1=CN(OC1=O)CCC(C(=O)O)N
Structure:
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