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

Systemtic Name: ethyl 1-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrrol-2-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrrole-2-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-2-pyrrolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-[(3-methoxyphenyl)methyl]-3,5-dimethylpyrrole-2-carbonyl]piperidine-4-carboxylate Traditional Name: 1-(1-m-anisyl-3,5-dimethyl-pyrrole-2-carbonyl)isonipecotic acid ethyl ester Formula: C23H30N2O4 MolecularWeight: 398.4953

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C=C(N2CC3=CC(=CC=C3)OC)C)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C=C(N2CC3=CC(=CC=C3)OC)C)C

InChI

InChI=1S/C23H30N2O4/c1-5-29-23(27)19-9-11-24(12-10-19)22(26)21-16(2)13-17(3)25(21)15-18-7-6-8-20(14-18)28-4/h6-8,13-14,19H,5,9-12,15H2,1-4H3