CAS RN: 71701-16-1
CAS Name: sodium; chromium(3+); 2-(3-cyanophenyl)-5-methyl-4-[4-(methylsulfamoyl)-2-oxidophenyl]azo-3-pyrazololate
OPENEYE Name: chromic sodium 2-(3-cyanophenyl)-5-methyl-4-[4-(methylsulfamoyl)-2-oxido-phenyl]azo-pyrazol-3-olate
IUPAC Name: sodium; chromium(3+); 2-(3-cyanophenyl)-5-methyl-4-[[4-(methylsulfamoyl)-2-oxidophenyl]diazenyl]pyrazol-3-olate
SYSTEMATIC NAME: sodium; chromium(3+); 2-(3-cyanophenyl)-5-methyl-4-[[4-(methylsulfamoyl)-2-oxidanidyl-phenyl]diazenyl]pyrazol-3-olate
MOLECULAR FORMULA: C36H28CrN12NaO8S2
MOLECULAR WEIGHT: 895.79899
SMILES: CC1=NN(C(=C1N=NC2=C(C=C(C=C2)S(=O)(=O)NC)[O-])[O-])C3=CC=CC(=C3)C#N.CC1=NN(C(=C1N=NC2=C(C=C(C=C2)S(=O)(=O)NC)[O-])[O-])C3=CC=CC(=C3)C#N.[Na+].[Cr+3]
Structure:
CAS RN: 71701-13-8
CAS Name: sodium; 2-[[1-(4-chlorophenyl)-3-methyl-5-oxido-4-pyrazolyl]azo]benzoate; chromium(3+)
OPENEYE Name: chromic sodium 2-[1-(4-chlorophenyl)-3-methyl-5-oxido-pyrazol-4-yl]azobenzoate
IUPAC Name: sodium; 2-[[1-(4-chlorophenyl)-3-methyl-5-oxidopyrazol-4-yl]diazenyl]benzoate; chromium(3+)
SYSTEMATIC NAME: sodium; 2-[[1-(4-chlorophenyl)-3-methyl-5-oxidanidyl-pyrazol-4-yl]diazenyl]benzoate; chromium(3+)
MOLECULAR FORMULA: C34H22Cl2CrN8NaO6
MOLECULAR WEIGHT: 784.48035
SMILES: CC1=NN(C(=C1N=NC2=CC=CC=C2C(=O)[O-])[O-])C3=CC=C(C=C3)Cl.CC1=NN(C(=C1N=NC2=CC=CC=C2C(=O)[O-])[O-])C3=CC=C(C=C3)Cl.[Na+].[Cr+3]
Structure:
CAS RN: 71696-92-9
CAS Name: (8R,9S,13S,14S,17S)-6-iodo-13-methyl-8,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthrene-3,17-diol
OPENEYE Name: (8R,9S,13S,14S,17S)-6-iodo-13-methyl-8,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthrene-3,17-diol
IUPAC Name: (8R,9S,13S,14S,17S)-6-iodo-13-methyl-8,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthrene-3,17-diol
SYSTEMATIC NAME: (8R,9S,13S,14S,17S)-6-iodanyl-13-methyl-8,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthrene-3,17-diol
MOLECULAR FORMULA: C18H21IO2
MOLECULAR WEIGHT: 396.26261
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)C=C(C4=C3C=CC(=C4)O)I
Structure:
CAS RN: 71686-25-4
CAS Name: 4,4-bis(4-hydroxyphenyl)pentanoic acid; butane-1,4-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid
OPENEYE Name: adipic acid; 4,4-bis(4-hydroxyphenyl)pentanoic acid; butane-1,4-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol
IUPAC Name: 4,4-bis(4-hydroxyphenyl)pentanoic acid; butane-1,4-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid
SYSTEMATIC NAME: 4,4-bis(4-hydroxyphenyl)pentanoic acid; butane-1,4-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid
MOLECULAR FORMULA: C33H52O13
MOLECULAR WEIGHT: 656.75818
SMILES: CCC(CO)(CO)CO.CC(CCC(=O)O)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C(CCC(=O)O)CC(=O)O.C(CCO)CO
Structure:
CAS RN: 71685-02-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C49H69N13O9
MOLECULAR WEIGHT: 984.15386
SMILES: C1CCNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H]4CCCN4C(=O)[C@H](C1)N)CC5=CC=CC=C5)CC6=CC=CC=C6)CCCN=C(N)N
Structure:
CAS RN: 71673-21-7
CAS Name: 2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide; (2,5-dioxo-4-imidazolidinyl)urea
OPENEYE Name: 2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethyl-butanamide; (2,5-dioxoimidazolidin-4-yl)urea
IUPAC Name: 2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide; (2,5-dioxoimidazolidin-4-yl)urea
SYSTEMATIC NAME: 1-[2,5-bis(oxidanylidene)imidazolidin-4-yl]urea; 3,3-dimethyl-2,4-bis(oxidanyl)-N-(3-oxidanylpropyl)butanamide
MOLECULAR FORMULA: C13H25N5O7
MOLECULAR WEIGHT: 363.3669
SMILES: CC(C)(CO)C(C(=O)NCCCO)O.C1(C(=O)NC(=O)N1)NC(=O)N
Structure:
CAS RN: 71659-79-5
CAS Name: 3-[[4-[[(2,3-dihydroxy-5-sulfophenyl)-oxomethyl]-[3-[[(2,3-dihydroxy-5-sulfophenyl)-oxomethyl]amino]propyl]amino]butylamino]-oxomethyl]-4,5-dihydroxybenzenesulfonic acid
OPENEYE Name: 3-[4-[(2,3-dihydroxy-5-sulfo-benzoyl)-[3-[(2,3-dihydroxy-5-sulfo-benzoyl)amino]propyl]amino]butylcarbamoyl]-4,5-dihydroxy-benzenesulfonic acid
IUPAC Name: 3-[4-[(2,3-dihydroxy-5-sulfobenzoyl)-[3-[(2,3-dihydroxy-5-sulfobenzoyl)amino]propyl]amino]butylcarbamoyl]-4,5-dihydroxybenzenesulfonic acid
SYSTEMATIC NAME: 3-[4-[[2,3-bis(oxidanyl)-5-sulfo-phenyl]carbonyl-[3-[[2,3-bis(oxidanyl)-5-sulfo-phenyl]carbonylamino]propyl]amino]butylcarbamoyl]-4,5-bis(oxidanyl)benzenesulfonic acid
MOLECULAR FORMULA: C28H31N3O18S3
MOLECULAR WEIGHT: 793.75004
SMILES: C1=C(C=C(C(=C1O)O)C(=O)NCCCCN(CCCNC(=O)C2=CC(=CC(=C2O)O)S(=O)(=O)O)C(=O)C3=CC(=CC(=C3O)O)S(=O)(=O)O)S(=O)(=O)O
Structure:
CAS RN: 121249-42-1
CAS Name: hexadecanoic acid [(2R,3R,4S)-4-hydroxy-2-[(1R)-2-hydroxy-1-(1-oxohexadecoxy)ethyl]-3-oxolanyl] ester
OPENEYE Name: [(2R,3R,4S)-2-[(1R)-1-hexadecanoyloxy-2-hydroxy-ethyl]-4-hydroxy-tetrahydrofuran-3-yl] hexadecanoate
IUPAC Name: [(2R,3R,4S)-2-[(1R)-1-hexadecanoyloxy-2-hydroxyethyl]-4-hydroxyoxolan-3-yl] hexadecanoate
SYSTEMATIC NAME: [(2R,3R,4S)-2-[(1R)-1-hexadecanoyloxy-2-oxidanyl-ethyl]-4-oxidanyl-oxolan-3-yl] hexadecanoate
MOLECULAR FORMULA: C38H72O7
MOLECULAR WEIGHT: 640.97408
SMILES: CCCCCCCCCCCCCCCC(=O)O[C@@H]1[C@H](CO[C@@H]1[C@@H](CO)OC(=O)CCCCCCCCCCCCCCC)O
Structure:
CAS RN: 71617-69-1
CAS Name: hexadecanoic acid [(2R,3R,4S)-4-hydroxy-2-[(1R)-2-hydroxy-1-(1-oxohexadecoxy)ethyl]-3-oxolanyl] ester
OPENEYE Name: [(2R,3R,4S)-2-[(1R)-1-hexadecanoyloxy-2-hydroxy-ethyl]-4-hydroxy-tetrahydrofuran-3-yl] hexadecanoate
IUPAC Name: [(2R,3R,4S)-2-[(1R)-1-hexadecanoyloxy-2-hydroxyethyl]-4-hydroxyoxolan-3-yl] hexadecanoate
SYSTEMATIC NAME: [(2R,3R,4S)-2-[(1R)-1-hexadecanoyloxy-2-oxidanyl-ethyl]-4-oxidanyl-oxolan-3-yl] hexadecanoate
MOLECULAR FORMULA: C38H72O7
MOLECULAR WEIGHT: 640.97408
SMILES: CCCCCCCCCCCCCCCC(=O)O[C@@H]1[C@H](CO[C@@H]1[C@@H](CO)OC(=O)CCCCCCCCCCCCCCC)O
Structure:
CAS RN: 98013-86-6
CAS Name: hexadecanoic acid [(2R,3R,4S)-4-hydroxy-2-[(1R)-2-hydroxy-1-(1-oxohexadecoxy)ethyl]-3-oxolanyl] ester
OPENEYE Name: [(2R,3R,4S)-2-[(1R)-1-hexadecanoyloxy-2-hydroxy-ethyl]-4-hydroxy-tetrahydrofuran-3-yl] hexadecanoate
IUPAC Name: [(2R,3R,4S)-2-[(1R)-1-hexadecanoyloxy-2-hydroxyethyl]-4-hydroxyoxolan-3-yl] hexadecanoate
SYSTEMATIC NAME: [(2R,3R,4S)-2-[(1R)-1-hexadecanoyloxy-2-oxidanyl-ethyl]-4-oxidanyl-oxolan-3-yl] hexadecanoate
MOLECULAR FORMULA: C38H72O7
MOLECULAR WEIGHT: 640.97408
SMILES: CCCCCCCCCCCCCCCC(=O)O[C@@H]1[C@H](CO[C@@H]1[C@@H](CO)OC(=O)CCCCCCCCCCCCCCC)O
Structure:
CAS RN: 71609-37-5
CAS Name: (3R,4S)-4-hydroxy-3-piperidinecarboxylic acid
OPENEYE Name: (3R,4S)-4-hydroxypiperidine-3-carboxylic acid
IUPAC Name: (3R,4S)-4-hydroxypiperidine-3-carboxylic acid
SYSTEMATIC NAME: (3R,4S)-4-oxidanylpiperidine-3-carboxylic acid
MOLECULAR FORMULA: C6H11NO3
MOLECULAR WEIGHT: 145.15644
SMILES: C1CNC[C@H]([C@H]1O)C(=O)O
Structure:
CAS RN: 71598-35-1
CAS Name: 2-(3-chlorophenyl)-5-methyl-4-(5-methylsulfonyl-2-oxidophenyl)azo-3-pyrazololate; chromium(3+); hydron
OPENEYE Name: chromic; 2-(3-chlorophenyl)-5-methyl-4-(5-methylsulfonyl-2-oxido-phenyl)azo-pyrazol-3-olate; hydron
IUPAC Name: 2-(3-chlorophenyl)-5-methyl-4-[(5-methylsulfonyl-2-oxidophenyl)diazenyl]pyrazol-3-olate; chromium(3+); hydron
SYSTEMATIC NAME: 2-(3-chlorophenyl)-5-methyl-4-[(5-methylsulfonyl-2-oxidanidyl-phenyl)diazenyl]pyrazol-3-olate; chromium(3+); hydron
MOLECULAR FORMULA: C34H27Cl2CrN8O8S2
MOLECULAR WEIGHT: 862.65908
SMILES: [H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)C)[O-])[O-])C3=CC(=CC=C3)Cl.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)C)[O-])[O-])C3=CC(=CC=C3)Cl.[Cr+3]
Structure:
CAS RN: 71598-33-9
CAS Name: 8-acetamido-1-(5-methylsulfonyl-2-oxidophenyl)azo-2-naphthalenolate; 2-(3-chlorophenyl)-5-methyl-4-(5-methylsulfonyl-2-oxidophenyl)azo-3-pyrazololate; chromium(3+); hydron
OPENEYE Name: chromic; 8-acetamido-1-(5-methylsulfonyl-2-oxido-phenyl)azo-naphthalen-2-olate; 2-(3-chlorophenyl)-5-methyl-4-(5-methylsulfonyl-2-oxido-phenyl)azo-pyrazol-3-olate; hydron
IUPAC Name: 8-acetamido-1-[(5-methylsulfonyl-2-oxidophenyl)diazenyl]naphthalen-2-olate; 2-(3-chlorophenyl)-5-methyl-4-[(5-methylsulfonyl-2-oxidophenyl)diazenyl]pyrazol-3-olate; chromium(3+); hydron
SYSTEMATIC NAME: 8-acetamido-1-[(5-methylsulfonyl-2-oxidanidyl-phenyl)diazenyl]naphthalen-2-olate; 2-(3-chlorophenyl)-5-methyl-4-[(5-methylsulfonyl-2-oxidanidyl-phenyl)diazenyl]pyrazol-3-olate; chromium(3+); hydron
MOLECULAR FORMULA: C36H29ClCrN7O9S2
MOLECULAR WEIGHT: 855.23606
SMILES: [H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)C)[O-])[O-])C3=CC(=CC=C3)Cl.CC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)C)[O-].[Cr+3]
Structure:
CAS RN: 71598-32-8
CAS Name: chromium(3+); 2-[[1-(2-ethylphenyl)-3-methyl-5-oxido-4-pyrazolyl]azo]benzoate; hydron
OPENEYE Name: chromic; 2-[1-(2-ethylphenyl)-3-methyl-5-oxido-pyrazol-4-yl]azobenzoate; hydron
IUPAC Name: chromium(3+); 2-[[1-(2-ethylphenyl)-3-methyl-5-oxidopyrazol-4-yl]diazenyl]benzoate; hydron
SYSTEMATIC NAME: chromium(3+); 2-[[1-(2-ethylphenyl)-3-methyl-5-oxidanidyl-pyrazol-4-yl]diazenyl]benzoate; hydron
MOLECULAR FORMULA: C38H33CrN8O6
MOLECULAR WEIGHT: 749.71472
SMILES: [H+].CCC1=CC=CC=C1N2C(=C(C(=N2)C)N=NC3=CC=CC=C3C(=O)[O-])[O-].CCC1=CC=CC=C1N2C(=C(C(=N2)C)N=NC3=CC=CC=C3C(=O)[O-])[O-].[Cr+3]
Structure:
CAS RN: 71593-10-7
CAS Name: 5-[(3S)-6,7-dimethoxy-3,4-dihydro-2H-1-benzopyran-3-yl]-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione
OPENEYE Name: 5-[(3S)-6,7-dimethoxychroman-3-yl]-2,3-dimethoxy-1,4-benzoquinone
IUPAC Name: 5-[(3S)-6,7-dimethoxy-3,4-dihydro-2H-chromen-3-yl]-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione
SYSTEMATIC NAME: 5-[(3S)-6,7-dimethoxy-3,4-dihydro-2H-chromen-3-yl]-2,3-dimethoxy-cyclohexa-2,5-diene-1,4-dione
MOLECULAR FORMULA: C19H20O7
MOLECULAR WEIGHT: 360.3579
SMILES: COC1=C(C=C2C(=C1)C[C@H](CO2)C3=CC(=O)C(=C(C3=O)OC)OC)OC
Structure:
CAS RN: 71566-74-0
CAS Name: 4-[2-chloroethyl(ethyl)amino]benzaldehyde; 4-methylpyridine
OPENEYE Name: 4-[2-chloroethyl(ethyl)amino]benzaldehyde; 4-methylpyridine
IUPAC Name: 4-[2-chloroethyl(ethyl)amino]benzaldehyde; 4-methylpyridine
SYSTEMATIC NAME: 4-[2-chloroethyl(ethyl)amino]benzaldehyde; 4-methylpyridine
MOLECULAR FORMULA: C17H21ClN2O
MOLECULAR WEIGHT: 304.81444
SMILES: CCN(CCCl)C1=CC=C(C=C1)C=O.CC1=CC=NC=C1
Structure:
CAS RN: 71566-56-8
CAS Name: 1-butanamine; 4-chloro-3-(3-methyl-5-oxo-4-phenyldiazenyl-4H-pyrazol-1-yl)benzenesulfonic acid
OPENEYE Name: butan-1-amine; 4-chloro-3-(3-methyl-5-oxo-4-phenylazo-4H-pyrazol-1-yl)benzenesulfonic acid
IUPAC Name: butan-1-amine; 4-chloro-3-(3-methyl-5-oxo-4-phenyldiazenyl-4H-pyrazol-1-yl)benzenesulfonic acid
SYSTEMATIC NAME: butan-1-amine; 4-chloranyl-3-(3-methyl-5-oxidanylidene-4-phenyldiazenyl-4H-pyrazol-1-yl)benzenesulfonic acid
MOLECULAR FORMULA: C20H24ClN5O4S
MOLECULAR WEIGHT: 465.95366
SMILES: CCCCN.CC1=NN(C(=O)C1N=NC2=CC=CC=C2)C3=C(C=CC(=C3)S(=O)(=O)O)Cl
Structure:
CAS RN: 71566-53-5
CAS Name: 9-ethyl-2,5-dimethyl-8,10-dioxaspiro[5.5]undec-2-ene
OPENEYE Name: 9-ethyl-2,5-dimethyl-8,10-dioxaspiro[5.5]undec-2-ene
IUPAC Name: 9-ethyl-2,5-dimethyl-8,10-dioxaspiro[5.5]undec-2-ene
SYSTEMATIC NAME: 9-ethyl-2,5-dimethyl-8,10-dioxaspiro[5.5]undec-2-ene
MOLECULAR FORMULA: C13H22O2
MOLECULAR WEIGHT: 210.31258
SMILES: CCC1OCC2(CC(=CCC2C)C)CO1
Structure:
CAS RN: 10603-06-2
CAS Name: 4,4,6-trimethyl-2-oxanone
OPENEYE Name: 4,4,6-trimethyltetrahydropyran-2-one
IUPAC Name: 4,4,6-trimethyloxan-2-one
SYSTEMATIC NAME: 4,4,6-trimethyloxan-2-one
MOLECULAR FORMULA: C8H14O2
MOLECULAR WEIGHT: 142.19556
SMILES: CC1CC(CC(=O)O1)(C)C
Structure:
CAS RN: 71566-51-3
CAS Name: 4,4,6-trimethyl-2-oxanone
OPENEYE Name: 4,4,6-trimethyltetrahydropyran-2-one
IUPAC Name: 4,4,6-trimethyloxan-2-one
SYSTEMATIC NAME: 4,4,6-trimethyloxan-2-one
MOLECULAR FORMULA: C8H14O2
MOLECULAR WEIGHT: 142.19556
SMILES: CC1CC(CC(=O)O1)(C)C
Structure:
CAS RN: 71566-34-2
CAS Name: 2-[(2-azanidyl-1-naphthalenyl)azo]-5-nitrophenolate; cobalt(3+); hydron
OPENEYE Name: cobaltic; 2-[(2-azanidyl-1-naphthyl)azo]-5-nitro-phenolate; hydron
IUPAC Name: 2-[(2-azanidylnaphthalen-1-yl)diazenyl]-5-nitrophenolate; cobalt(3+); hydron
SYSTEMATIC NAME: 2-[(2-azanidylnaphthalen-1-yl)diazenyl]-5-nitro-phenolate; cobalt(3+); hydron
MOLECULAR FORMULA: C32H21CoN8O6
MOLECULAR WEIGHT: 672.49234
SMILES: [H+].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C=C3)[N+](=O)[O-])[O-])[NH-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C=C3)[N+](=O)[O-])[O-])[NH-].[Co+3]
Structure:
CAS RN: 71566-31-9
CAS Name: chromium(3+); hydron; 1-[2-oxido-5-(propan-2-ylsulfamoyl)phenyl]azo-2-naphthalenolate; 2-propanamine
OPENEYE Name: chromic; hydron; 1-[5-(isopropylsulfamoyl)-2-oxido-phenyl]azonaphthalen-2-olate; propan-2-amine
IUPAC Name: chromium(3+); hydron; 1-[[2-oxido-5-(propan-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-2-olate; propan-2-amine
SYSTEMATIC NAME: chromium(3+); hydron; 1-[[2-oxidanidyl-5-(propan-2-ylsulfamoyl)phenyl]diazenyl]naphthalen-2-olate; propan-2-amine
MOLECULAR FORMULA: C41H44CrN7O8S2
MOLECULAR WEIGHT: 878.95626
SMILES: [H+].CC(C)N.CC(C)NS(=O)(=O)C1=CC(=C(C=C1)[O-])N=NC2=C(C=CC3=CC=CC=C32)[O-].CC(C)NS(=O)(=O)C1=CC(=C(C=C1)[O-])N=NC2=C(C=CC3=CC=CC=C32)[O-].[Cr+3]
Structure:
CAS RN: 71566-29-5
CAS Name: chromium(3+); hydron; 5-methyl-4-[2-oxido-5-(propan-2-ylsulfamoyl)phenyl]azo-2-phenyl-3-pyrazololate; 2-propanamine
OPENEYE Name: chromic; hydron; 4-[5-(isopropylsulfamoyl)-2-oxido-phenyl]azo-5-methyl-2-phenyl-pyrazol-3-olate; propan-2-amine
IUPAC Name: chromium(3+); hydron; 5-methyl-4-[[2-oxido-5-(propan-2-ylsulfamoyl)phenyl]diazenyl]-2-phenylpyrazol-3-olate; propan-2-amine
SYSTEMATIC NAME: chromium(3+); hydron; 5-methyl-4-[[2-oxidanidyl-5-(propan-2-ylsulfamoyl)phenyl]diazenyl]-2-phenyl-pyrazol-3-olate; propan-2-amine
MOLECULAR FORMULA: C41H48CrN11O8S2
MOLECULAR WEIGHT: 939.01482
SMILES: [H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)NC(C)C)[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)NC(C)C)[O-])[O-])C3=CC=CC=C3.CC(C)N.[Cr+3]
Structure:
CAS RN: 71566-27-3
CAS Name: cobalt(3+); cyclohexanamine; 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; cyclohexanamine; 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+); cyclohexanamine; 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+); cyclohexanamine; hydron; 5-methyl-4-[(5-nitro-2-oxidanidyl-phenyl)diazenyl]-2-phenyl-pyrazol-3-olate
MOLECULAR FORMULA: C38H36CoN11O8
MOLECULAR WEIGHT: 833.69454
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.C1CCC(CC1)N.[Co+3]
Structure:
CAS RN: 71566-25-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C56H68CuN12O8S4
MOLECULAR WEIGHT: 1229.02072
SMILES: CCCCC(CC)CNS(=O)(=O)C1=CC2=C(C=C1)C3=NC4=NC(=NC5=C6C=C(C=CC6=C([N-]5)N=C7C8=C(C=CC(=C8)S(=O)(=O)NCCCC)C(=N7)N=C2[N-]3)S(=O)(=O)NCC(CC)CCCC)C9=C4C=C(C=C9)S(=O)(=O)NCCCC.[Cu+2]
Structure:
CAS RN: 71566-22-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C32H22CuN10O6S2
MOLECULAR WEIGHT: 770.25648
SMILES: C1=CC=C2C(=C1)C3=NC4=C5C=CC(=CC5=C([N-]4)N=C6C7=CC=CC=C7C(=N6)N=C8C9=C(C=C(C=C9)S(=O)(=O)[O-])C(=NC2=N3)[N-]8)S(=O)(=O)[O-].[NH4+].[NH4+].[Cu+2]
Structure:
No comments:
Post a Comment