CAS RN: 29007-65-6
CAS Name: (E)-3-(2-furanyl)-2-propenoic acid (7-nitro-8-quinolinyl) ester
OPENEYE Name: (7-nitro-8-quinolyl) (E)-3-(2-furyl)prop-2-enoate
IUPAC Name: (7-nitroquinolin-8-yl) (E)-3-(furan-2-yl)prop-2-enoate
SYSTEMATIC NAME: (7-nitroquinolin-8-yl) (E)-3-(furan-2-yl)prop-2-enoate
MOLECULAR FORMULA: C16H10N2O5
MOLECULAR WEIGHT: 310.261
SMILES: C1=CC2=C(C(=C(C=C2)[N+](=O)[O-])OC(=O)/C=C/C3=CC=CO3)N=C1
Structure:
CAS RN: 29007-27-0
CAS Name: (E)-3-phenyl-2-propenoic acid (7-nitro-8-quinolinyl) ester
OPENEYE Name: (7-nitro-8-quinolyl) (E)-3-phenylprop-2-enoate
IUPAC Name: (7-nitroquinolin-8-yl) (E)-3-phenylprop-2-enoate
SYSTEMATIC NAME: (7-nitroquinolin-8-yl) (E)-3-phenylprop-2-enoate
MOLECULAR FORMULA: C18H12N2O4
MOLECULAR WEIGHT: 320.29888
SMILES: C1=CC=C(C=C1)/C=C/C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-]
Structure:
CAS RN: 29002-41-3
CAS Name: (E)-3-(3,4-dimethoxyphenyl)-2-methyl-2-propenoic acid (7-nitro-8-quinolinyl) ester
OPENEYE Name: (7-nitro-8-quinolyl) (E)-3-(3,4-dimethoxyphenyl)-2-methyl-prop-2-enoate
IUPAC Name: (7-nitroquinolin-8-yl) (E)-3-(3,4-dimethoxyphenyl)-2-methylprop-2-enoate
SYSTEMATIC NAME: (7-nitroquinolin-8-yl) (E)-3-(3,4-dimethoxyphenyl)-2-methyl-prop-2-enoate
MOLECULAR FORMULA: C21H18N2O6
MOLECULAR WEIGHT: 394.37742
SMILES: C/C(=C\C1=CC(=C(C=C1)OC)OC)/C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-]
Structure:
CAS RN: 29002-40-2
CAS Name: (E)-3-(2,3-dimethoxyphenyl)-2-methyl-2-propenoic acid (7-nitro-8-quinolinyl) ester
OPENEYE Name: (7-nitro-8-quinolyl) (E)-3-(2,3-dimethoxyphenyl)-2-methyl-prop-2-enoate
IUPAC Name: (7-nitroquinolin-8-yl) (E)-3-(2,3-dimethoxyphenyl)-2-methylprop-2-enoate
SYSTEMATIC NAME: (7-nitroquinolin-8-yl) (E)-3-(2,3-dimethoxyphenyl)-2-methyl-prop-2-enoate
MOLECULAR FORMULA: C21H18N2O6
MOLECULAR WEIGHT: 394.37742
SMILES: C/C(=C\C1=C(C(=CC=C1)OC)OC)/C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-]
Structure:
CAS RN: 29002-37-7
CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-methyl-2-propenoic acid (7-nitro-8-quinolinyl) ester
OPENEYE Name: (7-nitro-8-quinolyl) (E)-3-(1,3-benzodioxol-5-yl)-2-methyl-prop-2-enoate
IUPAC Name: (7-nitroquinolin-8-yl) (E)-3-(1,3-benzodioxol-5-yl)-2-methylprop-2-enoate
SYSTEMATIC NAME: (7-nitroquinolin-8-yl) (E)-3-(1,3-benzodioxol-5-yl)-2-methyl-prop-2-enoate
MOLECULAR FORMULA: C20H14N2O6
MOLECULAR WEIGHT: 378.33496
SMILES: C/C(=C\C1=CC2=C(C=C1)OCO2)/C(=O)OC3=C(C=CC4=C3N=CC=C4)[N+](=O)[O-]
Structure:
CAS RN: 29002-35-5
CAS Name: (E)-2-methyl-3-(3-nitrophenyl)-2-propenoic acid (7-nitro-8-quinolinyl) ester
OPENEYE Name: (7-nitro-8-quinolyl) (E)-2-methyl-3-(3-nitrophenyl)prop-2-enoate
IUPAC Name: (7-nitroquinolin-8-yl) (E)-2-methyl-3-(3-nitrophenyl)prop-2-enoate
SYSTEMATIC NAME: (7-nitroquinolin-8-yl) (E)-2-methyl-3-(3-nitrophenyl)prop-2-enoate
MOLECULAR FORMULA: C19H13N3O6
MOLECULAR WEIGHT: 379.32302
SMILES: C/C(=C\C1=CC(=CC=C1)[N+](=O)[O-])/C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-]
Structure:
CAS RN: 29002-33-3
CAS Name: (E)-3-(2,4-dichlorophenyl)-2-methyl-2-propenoic acid (7-nitro-8-quinolinyl) ester
OPENEYE Name: (7-nitro-8-quinolyl) (E)-3-(2,4-dichlorophenyl)-2-methyl-prop-2-enoate
IUPAC Name: (7-nitroquinolin-8-yl) (E)-3-(2,4-dichlorophenyl)-2-methylprop-2-enoate
SYSTEMATIC NAME: (7-nitroquinolin-8-yl) (E)-3-(2,4-dichlorophenyl)-2-methyl-prop-2-enoate
MOLECULAR FORMULA: C19H12Cl2N2O4
MOLECULAR WEIGHT: 403.21558
SMILES: C/C(=C\C1=C(C=C(C=C1)Cl)Cl)/C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-]
Structure:
CAS RN: 29002-28-6
CAS Name: (E)-2-methyl-3-(4-methylphenyl)-2-propenoic acid (7-nitro-8-quinolinyl) ester
OPENEYE Name: (7-nitro-8-quinolyl) (E)-2-methyl-3-(p-tolyl)prop-2-enoate
IUPAC Name: (7-nitroquinolin-8-yl) (E)-2-methyl-3-(4-methylphenyl)prop-2-enoate
SYSTEMATIC NAME: (7-nitroquinolin-8-yl) (E)-2-methyl-3-(4-methylphenyl)prop-2-enoate
MOLECULAR FORMULA: C20H16N2O4
MOLECULAR WEIGHT: 348.35204
SMILES: CC1=CC=C(C=C1)/C=C(\C)/C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-]
Structure:
CAS RN: 29002-27-5
CAS Name: (E)-3-(2,4-dimethoxyphenyl)-2-propenoic acid (7-nitro-8-quinolinyl) ester
OPENEYE Name: (7-nitro-8-quinolyl) (E)-3-(2,4-dimethoxyphenyl)prop-2-enoate
IUPAC Name: (7-nitroquinolin-8-yl) (E)-3-(2,4-dimethoxyphenyl)prop-2-enoate
SYSTEMATIC NAME: (7-nitroquinolin-8-yl) (E)-3-(2,4-dimethoxyphenyl)prop-2-enoate
MOLECULAR FORMULA: C20H16N2O6
MOLECULAR WEIGHT: 380.35084
SMILES: COC1=CC(=C(C=C1)/C=C/C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-])OC
Structure:
CAS RN: 29002-23-1
CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-propenoic acid (7-nitro-8-quinolinyl) ester
OPENEYE Name: (7-nitro-8-quinolyl) (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate
IUPAC Name: (7-nitroquinolin-8-yl) (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate
SYSTEMATIC NAME: (7-nitroquinolin-8-yl) (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate
MOLECULAR FORMULA: C19H12N2O6
MOLECULAR WEIGHT: 364.30838
SMILES: C1OC2=C(O1)C=C(C=C2)/C=C/C(=O)OC3=C(C=CC4=C3N=CC=C4)[N+](=O)[O-]
Structure:
CAS RN: 29002-22-0
CAS Name: (E)-3-(4-nitrophenyl)-2-propenoic acid (7-nitro-8-quinolinyl) ester
OPENEYE Name: (7-nitro-8-quinolyl) (E)-3-(4-nitrophenyl)prop-2-enoate
IUPAC Name: (7-nitroquinolin-8-yl) (E)-3-(4-nitrophenyl)prop-2-enoate
SYSTEMATIC NAME: (7-nitroquinolin-8-yl) (E)-3-(4-nitrophenyl)prop-2-enoate
MOLECULAR FORMULA: C18H11N3O6
MOLECULAR WEIGHT: 365.29644
SMILES: C1=CC2=C(C(=C(C=C2)[N+](=O)[O-])OC(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-])N=C1
Structure:
CAS RN: 29002-21-9
CAS Name: (E)-3-(3-nitrophenyl)-2-propenoic acid (7-nitro-8-quinolinyl) ester
OPENEYE Name: (7-nitro-8-quinolyl) (E)-3-(3-nitrophenyl)prop-2-enoate
IUPAC Name: (7-nitroquinolin-8-yl) (E)-3-(3-nitrophenyl)prop-2-enoate
SYSTEMATIC NAME: (7-nitroquinolin-8-yl) (E)-3-(3-nitrophenyl)prop-2-enoate
MOLECULAR FORMULA: C18H11N3O6
MOLECULAR WEIGHT: 365.29644
SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-]
Structure:
CAS RN: 29002-07-1
CAS Name: (E)-2,3-diphenyl-2-propenoic acid (7-nitro-8-quinolinyl) ester
OPENEYE Name: (7-nitro-8-quinolyl) (E)-2,3-diphenylprop-2-enoate
IUPAC Name: (7-nitroquinolin-8-yl) (E)-2,3-diphenylprop-2-enoate
SYSTEMATIC NAME: (7-nitroquinolin-8-yl) (E)-2,3-diphenylprop-2-enoate
MOLECULAR FORMULA: C24H16N2O4
MOLECULAR WEIGHT: 396.39484
SMILES: C1=CC=C(C=C1)/C=C(\C2=CC=CC=C2)/C(=O)OC3=C(C=CC4=C3N=CC=C4)[N+](=O)[O-]
Structure:
CAS RN: 28810-22-2
CAS Name: (E)-2-butenedioic acid; N,N-dimethyl-2-[(6-methyl-5,5-dioxo-11H-benzo[c][1,2]benzothiazepin-11-yl)oxy]ethanamine
OPENEYE Name: N,N-dimethyl-2-[(6-methyl-5,5-dioxo-11H-benzo[c][1,2]benzothiazepin-11-yl)oxy]ethanamine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; N,N-dimethyl-2-[(6-methyl-5,5-dioxo-11H-benzo[c][1,2]benzothiazepin-11-yl)oxy]ethanamine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; N,N-dimethyl-2-[[6-methyl-5,5-bis(oxidanylidene)-11H-benzo[c][1,2]benzothiazepin-11-yl]oxy]ethanamine
MOLECULAR FORMULA: C22H26N2O7S
MOLECULAR WEIGHT: 462.51604
SMILES: CN1C2=CC=CC=C2C(C3=CC=CC=C3S1(=O)=O)OCCN(C)C.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 28744-92-5
CAS Name: (5Z)-5-[(3-bromophenyl)methylidene]imidazolidine-2,4-dione
OPENEYE Name: (5Z)-5-[(3-bromophenyl)methylene]imidazolidine-2,4-dione
IUPAC Name: (5Z)-5-[(3-bromophenyl)methylidene]imidazolidine-2,4-dione
SYSTEMATIC NAME: (5Z)-5-[(3-bromophenyl)methylidene]imidazolidine-2,4-dione
MOLECULAR FORMULA: C10H7BrN2O2
MOLECULAR WEIGHT: 267.07878
SMILES: C1=CC(=CC(=C1)Br)/C=C\2/C(=O)NC(=O)N2
Structure:
CAS RN: 28529-01-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H28N2O
MOLECULAR WEIGHT: 384.51332
SMILES: C1CN2C[C@@H]3C/C(=C/C4=CC=CC=C4)/C(C[C@H]3C[C@H]2C5=C1C6=CC=CC=C6N5)O
Structure:
CAS RN: 28477-81-8
CAS Name: 4-[[(4E,6E,10E,12E)-3-(3-carboxy-1-oxopropoxy)-14-(1,2-dioxopropylamino)-6,12,15,18-tetramethyl-16,19-dioxo-17-oxabicyclo[13.2.2]nonadeca-4,6,10,12-tetraen-9-yl]oxy]-4-oxobutanoic acid
OPENEYE Name: 4-[[(4E,6E,10E,12E)-3-(3-carboxypropanoyloxy)-6,12,15,18-tetramethyl-16,19-dioxo-14-(2-oxopropanoylamino)-17-oxabicyclo[13.2.2]nonadeca-4,6,10,12-tetraen-9-yl]oxy]-4-oxo-butanoic acid
IUPAC Name: 4-[[(4E,6E,10E,12E)-3-(3-carboxypropanoyloxy)-6,12,15,18-tetramethyl-16,19-dioxo-14-(2-oxopropanoylamino)-17-oxabicyclo[13.2.2]nonadeca-4,6,10,12-tetraen-9-yl]oxy]-4-oxobutanoic acid
SYSTEMATIC NAME: 4-oxidanylidene-4-[[(4E,6E,10E,12E)-6,12,15,18-tetramethyl-16,19-bis(oxidanylidene)-14-(2-oxidanylidenepropanoylamino)-3-(4-oxidanyl-4-oxidanylidene-butanoyl)oxy-17-oxabicyclo[13.2.2]nonadeca-4,6,10,12-tetraen-9-yl]oxy]butanoic acid
MOLECULAR FORMULA: C33H41NO13
MOLECULAR WEIGHT: 659.67754
SMILES: CC1C2CC(/C=C/C(=C/CC(/C=C/C(=C/C(C(C1=O)(C(=O)O2)C)NC(=O)C(=O)C)/C)OC(=O)CCC(=O)O)/C)OC(=O)CCC(=O)O
Structure:
CAS RN: 28272-08-4
CAS Name: 4-acetamido-N-[(2Z,4E)-1-hydrazinyl-1-oxo-5-phenylpenta-2,4-dien-2-yl]benzamide
OPENEYE Name: 4-acetamido-N-[(1Z,3E)-1-(hydrazinecarbonyl)-4-phenyl-buta-1,3-dienyl]benzamide
IUPAC Name: 4-acetamido-N-[(2Z,4E)-1-hydrazinyl-1-oxo-5-phenylpenta-2,4-dien-2-yl]benzamide
SYSTEMATIC NAME: 4-acetamido-N-[(2Z,4E)-1-diazanyl-1-oxidanylidene-5-phenyl-penta-2,4-dien-2-yl]benzamide
MOLECULAR FORMULA: C20H20N4O3
MOLECULAR WEIGHT: 364.3978
SMILES: CC(=O)NC1=CC=C(C=C1)C(=O)N/C(=C\C=C\C2=CC=CC=C2)/C(=O)NN
Structure:
CAS RN: 28272-07-3
CAS Name: 4-acetamido-N-[(Z)-1-(4-acetamidophenyl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
OPENEYE Name: 4-acetamido-N-[(Z)-2-(4-acetamidophenyl)-1-(hydrazinecarbonyl)vinyl]benzamide
IUPAC Name: 4-acetamido-N-[(Z)-1-(4-acetamidophenyl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
SYSTEMATIC NAME: 4-acetamido-N-[(Z)-1-(4-acetamidophenyl)-3-diazanyl-3-oxidanylidene-prop-1-en-2-yl]benzamide
MOLECULAR FORMULA: C20H21N5O4
MOLECULAR WEIGHT: 395.41184
SMILES: CC(=O)NC1=CC=C(C=C1)/C=C(/C(=O)NN)\NC(=O)C2=CC=C(C=C2)NC(=O)C
Structure:
CAS RN: 28272-06-2
CAS Name: 4-acetamido-N-[(Z)-3-hydrazinyl-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide
OPENEYE Name: 4-acetamido-N-[(Z)-1-(hydrazinecarbonyl)-2-(4-methoxyphenyl)vinyl]benzamide
IUPAC Name: 4-acetamido-N-[(Z)-3-hydrazinyl-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide
SYSTEMATIC NAME: 4-acetamido-N-[(Z)-3-diazanyl-1-(4-methoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide
MOLECULAR FORMULA: C19H20N4O4
MOLECULAR WEIGHT: 368.3865
SMILES: CC(=O)NC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=C(C=C2)OC)/C(=O)NN
Structure:
CAS RN: 28272-05-1
CAS Name: 4-acetamido-N-[(Z)-1-[4-(diethylamino)phenyl]-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
OPENEYE Name: 4-acetamido-N-[(Z)-2-[4-(diethylamino)phenyl]-1-(hydrazinecarbonyl)vinyl]benzamide
IUPAC Name: 4-acetamido-N-[(Z)-1-[4-(diethylamino)phenyl]-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
SYSTEMATIC NAME: 4-acetamido-N-[(Z)-3-diazanyl-1-[4-(diethylamino)phenyl]-3-oxidanylidene-prop-1-en-2-yl]benzamide
MOLECULAR FORMULA: C22H27N5O3
MOLECULAR WEIGHT: 409.48148
SMILES: CCN(CC)C1=CC=C(C=C1)/C=C(/C(=O)NN)\NC(=O)C2=CC=C(C=C2)NC(=O)C
Structure:
CAS RN: 28272-04-0
CAS Name: 4-acetamido-N-[(Z)-1-[4-(dimethylamino)phenyl]-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
OPENEYE Name: 4-acetamido-N-[(Z)-2-[4-(dimethylamino)phenyl]-1-(hydrazinecarbonyl)vinyl]benzamide
IUPAC Name: 4-acetamido-N-[(Z)-1-[4-(dimethylamino)phenyl]-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
SYSTEMATIC NAME: 4-acetamido-N-[(Z)-3-diazanyl-1-[4-(dimethylamino)phenyl]-3-oxidanylidene-prop-1-en-2-yl]benzamide
MOLECULAR FORMULA: C20H23N5O3
MOLECULAR WEIGHT: 381.42832
SMILES: CC(=O)NC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=C(C=C2)N(C)C)/C(=O)NN
Structure:
CAS RN: 28272-03-9
CAS Name: 4-acetamido-N-[(Z)-3-hydrazinyl-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
OPENEYE Name: 4-acetamido-N-[(Z)-1-(hydrazinecarbonyl)-2-(4-nitrophenyl)vinyl]benzamide
IUPAC Name: 4-acetamido-N-[(Z)-3-hydrazinyl-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
SYSTEMATIC NAME: 4-acetamido-N-[(Z)-3-diazanyl-1-(4-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide
MOLECULAR FORMULA: C18H17N5O5
MOLECULAR WEIGHT: 383.35808
SMILES: CC(=O)NC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/C(=O)NN
Structure:
CAS RN: 28272-02-8
CAS Name: 4-acetamido-N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
OPENEYE Name: 4-acetamido-N-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(hydrazinecarbonyl)vinyl]benzamide
IUPAC Name: 4-acetamido-N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
SYSTEMATIC NAME: 4-acetamido-N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-diazanyl-3-oxidanylidene-prop-1-en-2-yl]benzamide
MOLECULAR FORMULA: C19H18N4O5
MOLECULAR WEIGHT: 382.37002
SMILES: CC(=O)NC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC3=C(C=C2)OCO3)/C(=O)NN
Structure:
CAS RN: 28272-01-7
CAS Name: acetic acid [4-[(Z)-2-[[(4-acetamidophenyl)-oxomethyl]amino]-3-hydrazinyl-3-oxoprop-1-enyl]-2-methoxyphenyl] ester
OPENEYE Name: [4-[(Z)-2-[(4-acetamidobenzoyl)amino]-3-hydrazino-3-oxo-prop-1-enyl]-2-methoxy-phenyl] acetate
IUPAC Name: [4-[(Z)-2-[(4-acetamidobenzoyl)amino]-3-hydrazinyl-3-oxoprop-1-enyl]-2-methoxyphenyl] acetate
SYSTEMATIC NAME: [4-[(Z)-2-[(4-acetamidophenyl)carbonylamino]-3-diazanyl-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] ethanoate
MOLECULAR FORMULA: C21H22N4O6
MOLECULAR WEIGHT: 426.42258
SMILES: CC(=O)NC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC(=C(C=C2)OC(=O)C)OC)/C(=O)NN
Structure:
CAS RN: 28272-00-6
CAS Name: 4-acetamido-N-[(Z)-3-hydrazinyl-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
OPENEYE Name: 4-acetamido-N-[(Z)-1-(hydrazinecarbonyl)-2-(3-nitrophenyl)vinyl]benzamide
IUPAC Name: 4-acetamido-N-[(Z)-3-hydrazinyl-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
SYSTEMATIC NAME: 4-acetamido-N-[(Z)-3-diazanyl-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide
MOLECULAR FORMULA: C18H17N5O5
MOLECULAR WEIGHT: 383.35808
SMILES: CC(=O)NC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/C(=O)NN
Structure:
CAS RN: 28271-99-0
CAS Name: acetic acid [3-[(Z)-2-[[(4-acetamidophenyl)-oxomethyl]amino]-3-hydrazinyl-3-oxoprop-1-enyl]phenyl] ester
OPENEYE Name: [3-[(Z)-2-[(4-acetamidobenzoyl)amino]-3-hydrazino-3-oxo-prop-1-enyl]phenyl] acetate
IUPAC Name: [3-[(Z)-2-[(4-acetamidobenzoyl)amino]-3-hydrazinyl-3-oxoprop-1-enyl]phenyl] acetate
SYSTEMATIC NAME: [3-[(Z)-2-[(4-acetamidophenyl)carbonylamino]-3-diazanyl-3-oxidanylidene-prop-1-enyl]phenyl] ethanoate
MOLECULAR FORMULA: C20H20N4O5
MOLECULAR WEIGHT: 396.3966
SMILES: CC(=O)NC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC(=CC=C2)OC(=O)C)/C(=O)NN
Structure:
CAS RN: 28271-98-9
CAS Name: acetic acid [2-[(Z)-2-[[(4-acetamidophenyl)-oxomethyl]amino]-3-hydrazinyl-3-oxoprop-1-enyl]phenyl] ester
OPENEYE Name: [2-[(Z)-2-[(4-acetamidobenzoyl)amino]-3-hydrazino-3-oxo-prop-1-enyl]phenyl] acetate
IUPAC Name: [2-[(Z)-2-[(4-acetamidobenzoyl)amino]-3-hydrazinyl-3-oxoprop-1-enyl]phenyl] acetate
SYSTEMATIC NAME: [2-[(Z)-2-[(4-acetamidophenyl)carbonylamino]-3-diazanyl-3-oxidanylidene-prop-1-enyl]phenyl] ethanoate
MOLECULAR FORMULA: C20H20N4O5
MOLECULAR WEIGHT: 396.3966
SMILES: CC(=O)NC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=CC=C2OC(=O)C)/C(=O)NN
Structure:
CAS RN: 28271-97-8
CAS Name: 4-acetamido-N-[(Z)-1-(2-chlorophenyl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
OPENEYE Name: 4-acetamido-N-[(Z)-2-(2-chlorophenyl)-1-(hydrazinecarbonyl)vinyl]benzamide
IUPAC Name: 4-acetamido-N-[(Z)-1-(2-chlorophenyl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
SYSTEMATIC NAME: 4-acetamido-N-[(Z)-1-(2-chlorophenyl)-3-diazanyl-3-oxidanylidene-prop-1-en-2-yl]benzamide
MOLECULAR FORMULA: C18H17ClN4O3
MOLECULAR WEIGHT: 372.80558
SMILES: CC(=O)NC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=CC=C2Cl)/C(=O)NN
Structure:
CAS RN: 28271-96-7
CAS Name: 4-acetamido-N-[(Z)-3-hydrazinyl-3-oxo-1-phenylprop-1-en-2-yl]benzamide
OPENEYE Name: 4-acetamido-N-[(Z)-1-(hydrazinecarbonyl)-2-phenyl-vinyl]benzamide
IUPAC Name: 4-acetamido-N-[(Z)-3-hydrazinyl-3-oxo-1-phenylprop-1-en-2-yl]benzamide
SYSTEMATIC NAME: 4-acetamido-N-[(Z)-3-diazanyl-3-oxidanylidene-1-phenyl-prop-1-en-2-yl]benzamide
MOLECULAR FORMULA: C18H18N4O3
MOLECULAR WEIGHT: 338.36052
SMILES: CC(=O)NC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=CC=C2)/C(=O)NN
Structure:
CAS RN: 28268-50-0
CAS Name: propanoic acid [(4Z,6Z,10Z,12Z)-14-(1,2-dioxopropylamino)-9-hydroxy-6,12,15,18-tetramethyl-16,19-dioxo-17-oxabicyclo[13.2.2]nonadeca-4,6,10,12-tetraen-3-yl] ester
OPENEYE Name: [(4Z,6Z,10Z,12Z)-9-hydroxy-6,12,15,18-tetramethyl-16,19-dioxo-14-(2-oxopropanoylamino)-17-oxabicyclo[13.2.2]nonadeca-4,6,10,12-tetraen-3-yl] propanoate
IUPAC Name: [(4Z,6Z,10Z,12Z)-9-hydroxy-6,12,15,18-tetramethyl-16,19-dioxo-14-(2-oxopropanoylamino)-17-oxabicyclo[13.2.2]nonadeca-4,6,10,12-tetraen-3-yl] propanoate
SYSTEMATIC NAME: [(4Z,6Z,10Z,12Z)-6,12,15,18-tetramethyl-9-oxidanyl-16,19-bis(oxidanylidene)-14-(2-oxidanylidenepropanoylamino)-17-oxabicyclo[13.2.2]nonadeca-4,6,10,12-tetraen-3-yl] propanoate
MOLECULAR FORMULA: C28H37NO8
MOLECULAR WEIGHT: 515.59528
SMILES: CCC(=O)OC\1CC2C(C(=O)C(C(/C=C(\C=C/C(C/C=C(\C=C1)/C)O)/C)NC(=O)C(=O)C)(C(=O)O2)C)C
Structure:
CAS RN: 28268-49-7
CAS Name: propanoic acid [(4Z,6Z,10Z,12Z)-14-(1,2-dioxopropylamino)-3-hydroxy-6,12,15,18-tetramethyl-16,19-dioxo-17-oxabicyclo[13.2.2]nonadeca-4,6,10,12-tetraen-9-yl] ester
OPENEYE Name: [(4Z,6Z,10Z,12Z)-3-hydroxy-6,12,15,18-tetramethyl-16,19-dioxo-14-(2-oxopropanoylamino)-17-oxabicyclo[13.2.2]nonadeca-4,6,10,12-tetraen-9-yl] propanoate
IUPAC Name: [(4Z,6Z,10Z,12Z)-3-hydroxy-6,12,15,18-tetramethyl-16,19-dioxo-14-(2-oxopropanoylamino)-17-oxabicyclo[13.2.2]nonadeca-4,6,10,12-tetraen-9-yl] propanoate
SYSTEMATIC NAME: [(4Z,6Z,10Z,12Z)-6,12,15,18-tetramethyl-3-oxidanyl-16,19-bis(oxidanylidene)-14-(2-oxidanylidenepropanoylamino)-17-oxabicyclo[13.2.2]nonadeca-4,6,10,12-tetraen-9-yl] propanoate
MOLECULAR FORMULA: C28H37NO8
MOLECULAR WEIGHT: 515.59528
SMILES: CCC(=O)OC\1C/C=C(\C=C/C(CC2C(C(=O)C(C(/C=C(\C=C1)/C)NC(=O)C(=O)C)(C(=O)O2)C)C)O)/C
Structure:
CAS RN: 28241-06-7
CAS Name: (E)-2-butenedioic acid; 5-[(4-chlorophenyl)-(4,5-dihydro-1H-imidazol-2-yl)methyl]-1H-pyridin-2-one
OPENEYE Name: 5-[(4-chlorophenyl)-(4,5-dihydro-1H-imidazol-2-yl)methyl]-1H-pyridin-2-one; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 5-[(4-chlorophenyl)-(4,5-dihydro-1H-imidazol-2-yl)methyl]-1H-pyridin-2-one
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 5-[(4-chlorophenyl)-(4,5-dihydro-1H-imidazol-2-yl)methyl]-1H-pyridin-2-one
MOLECULAR FORMULA: C19H18ClN3O5
MOLECULAR WEIGHT: 403.81632
SMILES: C1CN=C(N1)C(C2=CC=C(C=C2)Cl)C3=CNC(=O)C=C3.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 28201-92-5
CAS Name: 4-acetamido-N-[(Z)-1-(2-furanyl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
OPENEYE Name: 4-acetamido-N-[(Z)-2-(2-furyl)-1-(hydrazinecarbonyl)vinyl]benzamide
IUPAC Name: 4-acetamido-N-[(Z)-1-(furan-2-yl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
SYSTEMATIC NAME: 4-acetamido-N-[(Z)-3-diazanyl-1-(furan-2-yl)-3-oxidanylidene-prop-1-en-2-yl]benzamide
MOLECULAR FORMULA: C16H16N4O4
MOLECULAR WEIGHT: 328.32264
SMILES: CC(=O)NC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=CO2)/C(=O)NN
Structure:
CAS RN: 28173-47-9
CAS Name: 2-[(Z)-1,4-dioxo-4-[2-(trimethylammonio)ethoxy]but-2-enoxy]ethyl-trimethylammonium diiodide
OPENEYE Name: trimethyl-[2-[(Z)-4-oxo-4-[2-(trimethylammonio)ethoxy]but-2-enoyl]oxyethyl]ammonium diiodide
IUPAC Name: trimethyl-[2-[(Z)-4-oxo-4-[2-(trimethylazaniumyl)ethoxy]but-2-enoyl]oxyethyl]azanium diiodide
SYSTEMATIC NAME: trimethyl-[2-[(Z)-4-oxidanylidene-4-[2-(trimethylazaniumyl)ethoxy]but-2-enoyl]oxyethyl]azanium diiodide
MOLECULAR FORMULA: C14H28I2N2O4
MOLECULAR WEIGHT: 542.19206
SMILES: C[N+](C)(C)CCOC(=O)/C=C\C(=O)OCC[N+](C)(C)C.[I-].[I-]
Structure:
CAS RN: 28131-68-2
CAS Name: (Z)-2-butenedioic acid; 1-(2,4-dimethoxyphenyl)-3-[4-[2-(3-methylbutoxy)-2-phenylethyl]-1-piperazinyl]-1-propanol
OPENEYE Name: 1-(2,4-dimethoxyphenyl)-3-[4-(2-isopentyloxy-2-phenyl-ethyl)piperazin-1-yl]propan-1-ol; maleic acid
IUPAC Name: (Z)-but-2-enedioic acid; 1-(2,4-dimethoxyphenyl)-3-[4-[2-(3-methylbutoxy)-2-phenylethyl]piperazin-1-yl]propan-1-ol
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 1-(2,4-dimethoxyphenyl)-3-[4-[2-(3-methylbutoxy)-2-phenyl-ethyl]piperazin-1-yl]propan-1-ol
MOLECULAR FORMULA: C36H50N2O12
MOLECULAR WEIGHT: 702.7884
SMILES: CC(CCOC(C1=CC=CC=C1)CN2CCN(CC2)CCC(O)C3=C(C=C(C=C3)OC)OC)C.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 50309-35-8
CAS Name: (E)-3-[4-[(6-amino-1-methyl-4-quinolin-1-iumyl)amino]phenyl]-N-[4-[(1-methyl-4-pyridin-1-iumyl)amino]phenyl]-2-propenamide; 4-methylbenzenesulfonate
OPENEYE Name: (E)-3-[4-[(6-amino-1-methyl-quinolin-1-ium-4-yl)amino]phenyl]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]prop-2-enamide; 4-methylbenzenesulfonate
IUPAC Name: (E)-3-[4-[(6-amino-1-methylquinolin-1-ium-4-yl)amino]phenyl]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]prop-2-enamide; 4-methylbenzenesulfonate
SYSTEMATIC NAME: (E)-3-[4-[(6-azanyl-1-methyl-quinolin-1-ium-4-yl)amino]phenyl]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]prop-2-enamide; 4-methylbenzenesulfonate
MOLECULAR FORMULA: C45H44N6O7S2
MOLECULAR WEIGHT: 844.99686
SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)NC4=C5C=C(C=CC5=[N+](C=C4)C)N
Structure:
CAS RN: 50309-27-8
CAS Name: 1-methyl-N4-[4-[(E)-2-[4-[(1-methyl-4-pyridin-1-iumyl)amino]phenyl]ethenyl]phenyl]quinolin-1-ium-4,6-diamine dibromide
OPENEYE Name: 1-methyl-N4-[4-[(E)-2-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]vinyl]phenyl]quinolin-1-ium-4,6-diamine dibromide
IUPAC Name: 1-methyl-4-N-[4-[(E)-2-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]ethenyl]phenyl]quinolin-1-ium-4,6-diamine dibromide
SYSTEMATIC NAME: 1-methyl-N4-[4-[(E)-2-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]ethenyl]phenyl]quinolin-1-ium-4,6-diamine dibromide
MOLECULAR FORMULA: C30H29Br2N5
MOLECULAR WEIGHT: 619.39276
SMILES: C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)/C=C/C3=CC=C(C=C3)NC4=C5C=C(C=CC5=[N+](C=C4)C)N.[Br-].[Br-]
Structure:
CAS RN: 50259-44-4
CAS Name: 4,4,6-trimethyl-2-[(E)-2-phenylethenyl]-5,6-dihydro-1,3-oxazine
OPENEYE Name: 4,4,6-trimethyl-2-[(E)-styryl]-5,6-dihydro-1,3-oxazine
IUPAC Name: 4,4,6-trimethyl-2-[(E)-2-phenylethenyl]-5,6-dihydro-1,3-oxazine
SYSTEMATIC NAME: 4,4,6-trimethyl-2-[(E)-2-phenylethenyl]-5,6-dihydro-1,3-oxazine
MOLECULAR FORMULA: C15H19NO
MOLECULAR WEIGHT: 229.31746
SMILES: CC1CC(N=C(O1)/C=C/C2=CC=CC=C2)(C)C
Structure:
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