ethyl 1-[5-(4-chlorophenyl)-2-methyl-1-(4-methylphenyl)pyrrol-3-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[5-(4-chlorophenyl)-2-methyl-1-(4-methylphenyl)pyrrol-3-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[5-(4-chlorophenyl)-2-methyl-1-(p-tolyl)pyrrole-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[5-(4-chlorophenyl)-2-methyl-1-(4-methylphenyl)-3-pyrrolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-(4-chlorophenyl)-2-methyl-1-(4-methylphenyl)pyrrole-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[5-(4-chlorophenyl)-2-methyl-1-(p-tolyl)pyrrole-3-carbonyl]isonipecotic acid ethyl ester Formula: C27H29ClN2O3 MolecularWeight: 464.98376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)C)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)C)C

InChI

InChI=1S/C27H29ClN2O3/c1-4-33-27(32)21-13-15-29(16-14-21)26(31)24-17-25(20-7-9-22(28)10-8-20)30(19(24)3)23-11-5-18(2)6-12-23/h5-12,17,21H,4,13-16H2,1-3H3