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

Systemtic Name: ethyl 1-[5-(3-methoxyphenyl)-2-methyl-1-phenyl-pyrrol-3-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[5-(3-methoxyphenyl)-2-methyl-1-phenyl-pyrrole-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[5-(3-methoxyphenyl)-2-methyl-1-phenyl-3-pyrrolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-(3-methoxyphenyl)-2-methyl-1-phenylpyrrole-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[5-(3-methoxyphenyl)-2-methyl-1-phenyl-pyrrole-3-carbonyl]isonipecotic acid ethyl ester Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H30N2O4/c1-4-33-27(31)20-13-15-28(16-14-20)26(30)24-18-25(21-9-8-12-23(17-21)32-3)29(19(24)2)22-10-6-5-7-11-22/h5-12,17-18,20H,4,13-16H2,1-3H3