methyl 1-(2-phenylazanylethyl)-4-[phenyl(propanoyl)amino]piperidine-4-carboxylate

Systemtic Name: methyl 1-(2-phenylazanylethyl)-4-[phenyl(propanoyl)amino]piperidine-4-carboxylate Openeye Name: methyl 1-(2-anilinoethyl)-4-(N-propanoylanilino)piperidine-4-carboxylate CAS Name: 1-(2-anilinoethyl)-4-[N-(1-oxopropyl)anilino]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-anilinoethyl)-4-(N-propanoylanilino)piperidine-4-carboxylate Traditional Name: 1-(2-anilinoethyl)-4-(N-propionylanilino)isonipecotic acid methyl ester Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCNC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCNC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C24H31N3O3/c1-3-22(28)27(21-12-8-5-9-13-21)24(23(29)30-2)14-17-26(18-15-24)19-16-25-20-10-6-4-7-11-20/h4-13,25H,3,14-19H2,1-2H3