ethyl 3-[(4-chlorophenyl)-phenylazanyl-methyl]-5-methyl-2-oxidanylidene-1,3-dihydropyrrole-4-carboxylate

Systemtic Name: ethyl 3-[(4-chlorophenyl)-phenylazanyl-methyl]-5-methyl-2-oxidanylidene-1,3-dihydropyrrole-4-carboxylate Openeye Name: ethyl 3-[anilino-(4-chlorophenyl)methyl]-5-methyl-2-oxo-1,3-dihydropyrrole-4-carboxylate CAS Name: 3-[anilino-(4-chlorophenyl)methyl]-5-methyl-2-oxo-1,3-dihydropyrrole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[anilino-(4-chlorophenyl)methyl]-5-methyl-2-oxo-1,3-dihydropyrrole-4-carboxylate Traditional Name: 4-[anilino-(4-chlorophenyl)methyl]-5-keto-2-methyl-2-pyrroline-3-carboxylic acid ethyl ester Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)C1C(C2=CC=C(C=C2)Cl)NC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)C1C(C2=CC=C(C=C2)Cl)NC3=CC=CC=C3)C

InChI

InChI=1S/C21H21ClN2O3/c1-3-27-21(26)17-13(2)23-20(25)18(17)19(14-9-11-15(22)12-10-14)24-16-7-5-4-6-8-16/h4-12,18-19,24H,3H2,1-2H3,(H,23,25)