ethyl 1-[2-(1-methylpyrrol-2-yl)ethyl]-4-[(2-propanoylphenyl)amino]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(1-methylpyrrol-2-yl)ethyl]-4-[(2-propanoylphenyl)amino]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(1-methylpyrrol-2-yl)ethyl]-4-(2-propanoylanilino)piperidine-4-carboxylate CAS Name: 1-[2-(1-methyl-2-pyrrolyl)ethyl]-4-[2-(1-oxopropyl)anilino]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(1-methylpyrrol-2-yl)ethyl]-4-(2-propanoylanilino)piperidine-4-carboxylate Traditional Name: 1-[2-(1-methylpyrrol-2-yl)ethyl]-4-(2-propionylanilino)isonipecotic acid ethyl ester Formula: C24H33N3O3 MolecularWeight: 411.53712

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=CC=C1NC2(CCN(CC2)CCC3=CC=CN3C)C(=O)OCC

Isomeric SMILES

CCC(=O)C1=CC=CC=C1NC2(CCN(CC2)CCC3=CC=CN3C)C(=O)OCC

InChI

InChI=1S/C24H33N3O3/c1-4-22(28)20-10-6-7-11-21(20)25-24(23(29)30-5-2)13-17-27(18-14-24)16-12-19-9-8-15-26(19)3/h6-11,15,25H,4-5,12-14,16-18H2,1-3H3