methyl (2E)-4-(4-chlorophenyl)-4-oxidanylidene-2-(1-phenylpyrrolidin-2-ylidene)butanoate

Systemtic Name: methyl (2E)-4-(4-chlorophenyl)-4-oxidanylidene-2-(1-phenylpyrrolidin-2-ylidene)butanoate Openeye Name: methyl (2E)-4-(4-chlorophenyl)-4-oxo-2-(1-phenylpyrrolidin-2-ylidene)butanoate CAS Name: (2E)-4-(4-chlorophenyl)-4-oxo-2-(1-phenyl-2-pyrrolidinylidene)butanoic acid methyl ester IUPAC Name: methyl (2E)-4-(4-chlorophenyl)-4-oxo-2-(1-phenylpyrrolidin-2-ylidene)butanoate Traditional Name: (2E)-4-(4-chlorophenyl)-4-keto-2-(1-phenylpyrrolidin-2-ylidene)butyric acid methyl ester Formula: C21H20ClNO3 MolecularWeight: 369.8414

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C1CCCN1C2=CC=CC=C2)CC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)/C(=C/1\CCCN1C2=CC=CC=C2)/CC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H20ClNO3/c1-26-21(25)18(14-20(24)15-9-11-16(22)12-10-15)19-8-5-13-23(19)17-6-3-2-4-7-17/h2-4,6-7,9-12H,5,8,13-14H2,1H3/b19-18+