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

Systemtic Name: ethyl 4-[[1-(4-ethoxycarbonylphenyl)-4-oxidanylidene-2-(4-propan-2-ylphenyl)azetidin-2-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[1-(4-ethoxycarbonylphenyl)-2-(4-isopropylphenyl)-4-oxo-azetidine-2-carbonyl]amino]benzoate CAS Name: 4-[[[1-(4-ethoxycarbonylphenyl)-4-oxo-2-(4-propan-2-ylphenyl)-2-azetidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[1-(4-ethoxycarbonylphenyl)-4-oxo-2-(4-propan-2-ylphenyl)azetidine-2-carbonyl]amino]benzoate Traditional Name: 4-[[1-(4-carbethoxyphenyl)-4-keto-2-p-cumenyl-azetidine-2-carbonyl]amino]benzoic acid ethyl ester Formula: C31H32N2O6 MolecularWeight: 528.59558

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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)C(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)C(C)C

InChI

InChI=1S/C31H32N2O6/c1-5-38-28(35)22-9-15-25(16-10-22)32-30(37)31(24-13-7-21(8-14-24)20(3)4)19-27(34)33(31)26-17-11-23(12-18-26)29(36)39-6-2/h7-18,20H,5-6,19H2,1-4H3,(H,32,37)