CAS RN: 25968-91-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H21NO3
MOLECULAR WEIGHT: 299.36424
SMILES: CN1CCC23C4C1CC5=C2C(=C(C=C5)OC)OC3C(=O)CC4
Structure:
CAS RN: 7401-24-3
CAS Name: 2-(2-isoquinolin-2-iumyl)-1-(3-phenanthrenyl)ethanone
OPENEYE Name: 2-isoquinolin-2-ium-2-yl-1-(3-phenanthryl)ethanone
IUPAC Name: 2-isoquinolin-2-ium-2-yl-1-phenanthren-3-ylethanone
SYSTEMATIC NAME: 2-isoquinolin-2-ium-2-yl-1-phenanthren-3-yl-ethanone
MOLECULAR FORMULA: C25H18NO+
MOLECULAR WEIGHT: 348.41652
SMILES: C1=CC=C2C=[N+](C=CC2=C1)CC(=O)C3=CC4=C(C=CC5=CC=CC=C54)C=C3
Structure:
CAS RN: 6277-94-7
CAS Name: 1-phenyl-2-[4-(2-phenylethyl)-4-morpholin-4-iumyl]ethanone
OPENEYE Name: 1-phenyl-2-[4-(2-phenylethyl)morpholin-4-ium-4-yl]ethanone
IUPAC Name: 1-phenyl-2-[4-(2-phenylethyl)morpholin-4-ium-4-yl]ethanone
SYSTEMATIC NAME: 1-phenyl-2-[4-(2-phenylethyl)morpholin-4-ium-4-yl]ethanone
MOLECULAR FORMULA: C20H24NO2+
MOLECULAR WEIGHT: 310.41006
SMILES: C1COCC[N+]1(CCC2=CC=CC=C2)CC(=O)C3=CC=CC=C3
Structure:
CAS RN: 7401-21-0
CAS Name: 1-phenyl-2-(4-phenyl-4-morpholin-4-iumyl)ethanone
OPENEYE Name: 1-phenyl-2-(4-phenylmorpholin-4-ium-4-yl)ethanone
IUPAC Name: 1-phenyl-2-(4-phenylmorpholin-4-ium-4-yl)ethanone
SYSTEMATIC NAME: 1-phenyl-2-(4-phenylmorpholin-4-ium-4-yl)ethanone
MOLECULAR FORMULA: C18H20NO2+
MOLECULAR WEIGHT: 282.3569
SMILES: C1COCC[N+]1(CC(=O)C2=CC=CC=C2)C3=CC=CC=C3
Structure:
CAS RN: 140942-26-3
CAS Name: 5-amino-8-[4-[2-[4-[(4-amino-7-sulfo-1-naphthalenyl)azo]-2-sulfophenyl]ethenyl]-3-sulfophenyl]azo-2-naphthalenesulfonic acid
OPENEYE Name: 5-amino-8-[4-[2-[4-[(4-amino-7-sulfo-1-naphthyl)azo]-2-sulfo-phenyl]vinyl]-3-sulfo-phenyl]azo-naphthalene-2-sulfonic acid
IUPAC Name: 5-amino-8-[[4-[2-[4-[(4-amino-7-sulfonaphthalen-1-yl)diazenyl]-2-sulfophenyl]ethenyl]-3-sulfophenyl]diazenyl]naphthalene-2-sulfonic acid
SYSTEMATIC NAME: 5-azanyl-8-[[4-[2-[4-[(4-azanyl-7-sulfo-naphthalen-1-yl)diazenyl]-2-sulfo-phenyl]ethenyl]-3-sulfo-phenyl]diazenyl]naphthalene-2-sulfonic acid
MOLECULAR FORMULA: C34H26N6O12S4
MOLECULAR WEIGHT: 838.86324
SMILES: C1=CC(=C(C=C1N=NC2=C3C=C(C=CC3=C(C=C2)N)S(=O)(=O)O)S(=O)(=O)O)C=CC4=C(C=C(C=C4)N=NC5=C6C=C(C=CC6=C(C=C5)N)S(=O)(=O)O)S(=O)(=O)O
Structure:
CAS RN: 6276-93-3
CAS Name: 5-acetamido-2-[2-[4-[[[4-[2-(4-acetamido-2-sulfophenyl)ethenyl]-3-sulfoanilino]-oxomethyl]amino]-2-sulfophenyl]ethenyl]benzenesulfonic acid
OPENEYE Name: 5-acetamido-2-[2-[4-[[4-[2-(4-acetamido-2-sulfo-phenyl)vinyl]-3-sulfo-phenyl]carbamoylamino]-2-sulfo-phenyl]vinyl]benzenesulfonic acid
IUPAC Name: 5-acetamido-2-[2-[4-[[4-[2-(4-acetamido-2-sulfophenyl)ethenyl]-3-sulfophenyl]carbamoylamino]-2-sulfophenyl]ethenyl]benzenesulfonic acid
SYSTEMATIC NAME: 5-acetamido-2-[2-[4-[[4-[2-(4-acetamido-2-sulfo-phenyl)ethenyl]-3-sulfo-phenyl]carbamoylamino]-2-sulfo-phenyl]ethenyl]benzenesulfonic acid
MOLECULAR FORMULA: C33H30N4O15S4
MOLECULAR WEIGHT: 850.8691
SMILES: CC(=O)NC1=CC(=C(C=C1)C=CC2=C(C=C(C=C2)NC(=O)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC(=O)C)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O
Structure:
CAS RN: 6276-92-2
CAS Name: 2-(2-naphthalenylamino)-1,2-diphenylethanone
OPENEYE Name: 2-(2-naphthylamino)-1,2-diphenyl-ethanone
IUPAC Name: 2-(naphthalen-2-ylamino)-1,2-diphenylethanone
SYSTEMATIC NAME: 2-(naphthalen-2-ylamino)-1,2-diphenyl-ethanone
MOLECULAR FORMULA: C24H19NO
MOLECULAR WEIGHT: 337.41376
SMILES: C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)NC3=CC4=CC=CC=C4C=C3
Structure:
CAS RN: 1848-46-0
CAS Name: 2-(phenylmethyl)-1H-indazol-3-one
OPENEYE Name: 2-benzyl-1H-indazol-3-one
IUPAC Name: 2-benzyl-1H-indazol-3-one
SYSTEMATIC NAME: 2-(phenylmethyl)-1H-indazol-3-one
MOLECULAR FORMULA: C14H12N2O
MOLECULAR WEIGHT: 224.25788
SMILES: C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N2
Structure:
CAS RN: 1848-48-2
CAS Name: 2-[3-(1-piperidinyl)propyl]-1H-indazol-3-one
OPENEYE Name: 2-[3-(1-piperidyl)propyl]-1H-indazol-3-one
IUPAC Name: 2-(3-piperidin-1-ylpropyl)-1H-indazol-3-one
SYSTEMATIC NAME: 2-(3-piperidin-1-ylpropyl)-1H-indazol-3-one
MOLECULAR FORMULA: C15H21N3O
MOLECULAR WEIGHT: 259.34674
SMILES: C1CCN(CC1)CCCN2C(=O)C3=CC=CC=C3N2
Structure:
CAS RN: 17049-65-9
CAS Name: 2-phenyl-1H-indazol-3-one
OPENEYE Name: 2-phenyl-1H-indazol-3-one
IUPAC Name: 2-phenyl-1H-indazol-3-one
SYSTEMATIC NAME: 2-phenyl-1H-indazol-3-one
MOLECULAR FORMULA: C13H10N2O
MOLECULAR WEIGHT: 210.2313
SMILES: C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N2
Structure:
CAS RN: 6634-85-1
CAS Name: 5H-benzo[a]phenothiazine-6-sulfonic acid
OPENEYE Name: 5H-benzo[a]phenothiazine-6-sulfonic acid
IUPAC Name: 5H-benzo[a]phenothiazine-6-sulfonic acid
SYSTEMATIC NAME: 5H-benzo[a]phenothiazine-6-sulfonic acid
MOLECULAR FORMULA: C16H11NO3S2
MOLECULAR WEIGHT: 329.39344
SMILES: C1C2=CC=CC=C2C3=NC4=CC=CC=C4SC3=C1S(=O)(=O)O
Structure:
CAS RN: 6278-27-9
CAS Name: 2-methoxy-6-[1-(methylamino)-2-phenylethyl]phenol
OPENEYE Name: 2-methoxy-6-[1-(methylamino)-2-phenyl-ethyl]phenol
IUPAC Name: 2-methoxy-6-[1-(methylamino)-2-phenylethyl]phenol
SYSTEMATIC NAME: 2-methoxy-6-[1-(methylamino)-2-phenyl-ethyl]phenol
MOLECULAR FORMULA: C16H19NO2
MOLECULAR WEIGHT: 257.32756
SMILES: CNC(CC1=CC=CC=C1)C2=C(C(=CC=C2)OC)O
Structure:
CAS RN: 14683-47-7
CAS Name: N-methyl-1,1-diphenylmethanamine
OPENEYE Name: N-methyl-1,1-diphenyl-methanamine
IUPAC Name: N-methyl-1,1-diphenylmethanamine
SYSTEMATIC NAME: N-methyl-1,1-diphenyl-methanamine
MOLECULAR FORMULA: C14H15N
MOLECULAR WEIGHT: 197.2756
SMILES: CNC(C1=CC=CC=C1)C2=CC=CC=C2
Structure:
CAS RN: 7400-87-5
CAS Name: 2-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-2-[(3,4,5-trimethoxyphenyl)methyl]propanedioic acid diethyl ester
OPENEYE Name: diethyl 2-[2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl]-2-[(3,4,5-trimethoxyphenyl)methyl]propanedioate
IUPAC Name: diethyl 2-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-2-[(3,4,5-trimethoxyphenyl)methyl]propanedioate
SYSTEMATIC NAME: diethyl 2-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]-2-[(3,4,5-trimethoxyphenyl)methyl]propanedioate
MOLECULAR FORMULA: C26H30O10
MOLECULAR WEIGHT: 502.5104
SMILES: CCOC(=O)C(CC1=CC(=C(C(=C1)OC)OC)OC)(CC(=O)C2=CC3=C(C=C2)OCO3)C(=O)OCC
Structure:
CAS RN: 6269-16-5
CAS Name: 1-[1-(4-methoxyphenyl)-2-phenylethyl]-1-methylpiperidin-1-ium
OPENEYE Name: 1-[1-(4-methoxyphenyl)-2-phenyl-ethyl]-1-methyl-piperidin-1-ium
IUPAC Name: 1-[1-(4-methoxyphenyl)-2-phenylethyl]-1-methylpiperidin-1-ium
SYSTEMATIC NAME: 1-[1-(4-methoxyphenyl)-2-phenyl-ethyl]-1-methyl-piperidin-1-ium
MOLECULAR FORMULA: C21H28NO+
MOLECULAR WEIGHT: 310.45312
SMILES: C[N+]1(CCCCC1)C(CC2=CC=CC=C2)C3=CC=C(C=C3)OC
Structure:
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