ethyl 4-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2,5-dimethyl-1-(p-tolyl)pyrrole-3-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2,5-dimethyl-1-(p-tolyl)pyrrole-3-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C22H29N3O3 MolecularWeight: 383.48396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N(C(=C2)C)C3=CC=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N(C(=C2)C)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C22H29N3O3/c1-5-28-22(27)24-12-10-18(11-13-24)23-21(26)20-14-16(3)25(17(20)4)19-8-6-15(2)7-9-19/h6-9,14,18H,5,10-13H2,1-4H3,(H,23,26)