ethyl 4-[[2-(4-dimethylaminophenyl)-1-(4-ethoxycarbonylphenyl)-4-oxidanylidene-azetidin-2-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[2-(4-dimethylaminophenyl)-1-(4-ethoxycarbonylphenyl)-4-oxidanylidene-azetidin-2-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[2-(4-dimethylaminophenyl)-1-(4-ethoxycarbonylphenyl)-4-oxo-azetidine-2-carbonyl]amino]benzoate CAS Name: 4-[[[2-(4-dimethylaminophenyl)-1-(4-ethoxycarbonylphenyl)-4-oxo-2-azetidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-dimethylaminophenyl)-1-(4-ethoxycarbonylphenyl)-4-oxoazetidine-2-carbonyl]amino]benzoate Traditional Name: 4-[[1-(4-carbethoxyphenyl)-2-(4-dimethylaminophenyl)-4-keto-azetidine-2-carbonyl]amino]benzoic acid ethyl ester Formula: C30H31N3O6 MolecularWeight: 529.58364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2(CC(=O)N2C3=CC=C(C=C3)C(=O)OCC)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2(CC(=O)N2C3=CC=C(C=C3)C(=O)OCC)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C30H31N3O6/c1-5-38-27(35)20-7-13-23(14-8-20)31-29(37)30(22-11-17-24(18-12-22)32(3)4)19-26(34)33(30)25-15-9-21(10-16-25)28(36)39-6-2/h7-18H,5-6,19H2,1-4H3,(H,31,37)