ethyl 1-[3-[(4-chlorophenyl)amino]-3-oxidanylidene-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[3-[(4-chlorophenyl)amino]-3-oxidanylidene-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[3-(4-chloroanilino)-3-oxo-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate CAS Name: 1-[3-(4-chloroanilino)-3-oxopropyl]-2-methyl-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(4-chloroanilino)-3-oxopropyl]-2-methyl-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[3-(4-chloroanilino)-3-keto-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C23H23ClN2O3 MolecularWeight: 410.89332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CCC(=O)NC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CCC(=O)NC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C23H23ClN2O3/c1-3-29-23(28)20-15-21(17-7-5-4-6-8-17)26(16(20)2)14-13-22(27)25-19-11-9-18(24)10-12-19/h4-12,15H,3,13-14H2,1-2H3,(H,25,27)