CAS RN: 134937-61-4
CAS Name: 2-(2,5-dimethylphenoxy)-1-(1-pyrrolidinyl)ethanone
OPENEYE Name: 2-(2,5-dimethylphenoxy)-1-pyrrolidin-1-yl-ethanone
IUPAC Name: 2-(2,5-dimethylphenoxy)-1-pyrrolidin-1-ylethanone
SYSTEMATIC NAME: 2-(2,5-dimethylphenoxy)-1-pyrrolidin-1-yl-ethanone
MOLECULAR FORMULA: C14H19NO2
MOLECULAR WEIGHT: 233.30616
SMILES: CC1=CC(=C(C=C1)C)OCC(=O)N2CCCC2
Structure:
CAS RN: 51010-74-3
CAS Name: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)-2-propenenitrile
OPENEYE Name: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
IUPAC Name: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
MOLECULAR FORMULA: C15H10N2O3
MOLECULAR WEIGHT: 266.2515
SMILES: C1=CC(=CC=C1/C=C(\C#N)/C2=CC=C(C=C2)[N+](=O)[O-])O
Structure:
CAS RN: 1226-74-0
CAS Name: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)-2-propenenitrile
OPENEYE Name: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
IUPAC Name: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
MOLECULAR FORMULA: C15H10N2O3
MOLECULAR WEIGHT: 266.2515
SMILES: C1=CC(=CC=C1/C=C(\C#N)/C2=CC=C(C=C2)[N+](=O)[O-])O
Structure:
CAS RN: 14003-22-6
CAS Name: 1-(4-methoxyphenyl)-2H-tetrazole-5-thione
OPENEYE Name: 1-(4-methoxyphenyl)-2H-tetrazole-5-thione
IUPAC Name: 1-(4-methoxyphenyl)-2H-tetrazole-5-thione
SYSTEMATIC NAME: 1-(4-methoxyphenyl)-2H-1,2,3,4-tetrazole-5-thione
MOLECULAR FORMULA: C8H8N4OS
MOLECULAR WEIGHT: 208.24032
SMILES: COC1=CC=C(C=C1)N2C(=S)N=NN2
Structure:
CAS RN: 5681-27-6
CAS Name: (E)-3-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)-2-propenenitrile
OPENEYE Name: (E)-3-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
SYSTEMATIC NAME: (E)-3-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
MOLECULAR FORMULA: C17H14N2O4
MOLECULAR WEIGHT: 310.30406
SMILES: COC1=C(C=C(C=C1)/C=C(/C#N)\C2=CC=C(C=C2)[N+](=O)[O-])OC
Structure:
CAS RN: 59581-76-9
CAS Name: (2Z)-2-[(4-methoxyphenyl)methylidene]-3,4-dihydronaphthalen-1-one
OPENEYE Name: (2Z)-2-[(4-methoxyphenyl)methylene]tetralin-1-one
IUPAC Name: (2Z)-2-[(4-methoxyphenyl)methylidene]-3,4-dihydronaphthalen-1-one
SYSTEMATIC NAME: (2Z)-2-[(4-methoxyphenyl)methylidene]-3,4-dihydronaphthalen-1-one
MOLECULAR FORMULA: C18H16O2
MOLECULAR WEIGHT: 264.31844
SMILES: COC1=CC=C(C=C1)/C=C\2/CCC3=CC=CC=C3C2=O
Structure:
CAS RN: 5382-68-3
CAS Name: 1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate
IUPAC Name: ethyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate
SYSTEMATIC NAME: ethyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate
MOLECULAR FORMULA: C14H18FNO4S
MOLECULAR WEIGHT: 315.360423
SMILES: CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)F
Structure:
CAS RN: 24247-79-8
CAS Name: (2Z)-2-(1-naphthalenylmethylidene)-1-azabicyclo[2.2.2]octan-3-one
OPENEYE Name: (2Z)-2-(1-naphthylmethylene)quinuclidin-3-one
IUPAC Name: (2Z)-2-(naphthalen-1-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one
SYSTEMATIC NAME: (2Z)-2-(naphthalen-1-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one
MOLECULAR FORMULA: C18H17NO
MOLECULAR WEIGHT: 263.33368
SMILES: C1CN\2CCC1C(=O)/C2=C/C3=CC=CC4=CC=CC=C43
Structure:
CAS RN: 24123-91-9
CAS Name: (2Z)-2-(1-naphthalenylmethylidene)-1-azabicyclo[2.2.2]octan-3-one
OPENEYE Name: (2Z)-2-(1-naphthylmethylene)quinuclidin-3-one
IUPAC Name: (2Z)-2-(naphthalen-1-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one
SYSTEMATIC NAME: (2Z)-2-(naphthalen-1-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one
MOLECULAR FORMULA: C18H17NO
MOLECULAR WEIGHT: 263.33368
SMILES: C1CN\2CCC1C(=O)/C2=C/C3=CC=CC4=CC=CC=C43
Structure:
CAS RN: 77362-24-4
CAS Name: (4Z)-4-[(1-acetyl-3-indolyl)methylidene]-2-phenyl-5-oxazolone
OPENEYE Name: (4Z)-4-[(1-acetylindol-3-yl)methylene]-2-phenyl-oxazol-5-one
IUPAC Name: (4Z)-4-[(1-acetylindol-3-yl)methylidene]-2-phenyl-1,3-oxazol-5-one
SYSTEMATIC NAME: (4Z)-4-[(1-ethanoylindol-3-yl)methylidene]-2-phenyl-1,3-oxazol-5-one
MOLECULAR FORMULA: C20H14N2O3
MOLECULAR WEIGHT: 330.33676
SMILES: CC(=O)N1C=C(C2=CC=CC=C21)/C=C\3/C(=O)OC(=N3)C4=CC=CC=C4
Structure:
CAS RN: 312290-54-3
CAS Name: 3-(4-tert-butylphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
OPENEYE Name: 4-allyl-3-(4-tert-butylphenyl)-1H-1,2,4-triazole-5-thione
IUPAC Name: 3-(4-tert-butylphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
SYSTEMATIC NAME: 3-(4-tert-butylphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
MOLECULAR FORMULA: C15H19N3S
MOLECULAR WEIGHT: 273.39646
SMILES: CC(C)(C)C1=CC=C(C=C1)C2=NNC(=S)N2CC=C
Structure:
CAS RN: 59787-46-1
CAS Name: [4-[(2-methylphenyl)methyl]-1-piperazinyl]-(4-nitrophenyl)methanone
OPENEYE Name: (4-nitrophenyl)-[4-(o-tolylmethyl)piperazin-1-yl]methanone
IUPAC Name: [4-[(2-methylphenyl)methyl]piperazin-1-yl]-(4-nitrophenyl)methanone
SYSTEMATIC NAME: [4-[(2-methylphenyl)methyl]piperazin-1-yl]-(4-nitrophenyl)methanone
MOLECULAR FORMULA: C19H21N3O3
MOLECULAR WEIGHT: 339.38834
SMILES: CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]
Structure:
CAS RN: 58721-01-0
CAS Name: (3-fluorophenyl)-[4-[(4-nitrophenyl)methyl]-1-piperazinyl]methanone
OPENEYE Name: (3-fluorophenyl)-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]methanone
IUPAC Name: (3-fluorophenyl)-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]methanone
SYSTEMATIC NAME: (3-fluorophenyl)-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]methanone
MOLECULAR FORMULA: C18H18FN3O3
MOLECULAR WEIGHT: 343.352223
SMILES: C1CN(CCN1CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=CC=C3)F
Structure:
CAS RN: 23195-30-4
CAS Name: 3-(2-methoxyphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
OPENEYE Name: 4-allyl-3-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione
IUPAC Name: 3-(2-methoxyphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
SYSTEMATIC NAME: 3-(2-methoxyphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
MOLECULAR FORMULA: C12H13N3OS
MOLECULAR WEIGHT: 247.31612
SMILES: COC1=CC=CC=C1C2=NNC(=S)N2CC=C
Structure:
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