methyl 4-[phenyl(propanoyl)amino]-1-(3-phenylpropyl)piperidine-4-carboxylate

Systemtic Name: methyl 4-[phenyl(propanoyl)amino]-1-(3-phenylpropyl)piperidine-4-carboxylate Openeye Name: methyl 1-(3-phenylpropyl)-4-(N-propanoylanilino)piperidine-4-carboxylate CAS Name: 4-[N-(1-oxopropyl)anilino]-1-(3-phenylpropyl)-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-phenylpropyl)-4-(N-propanoylanilino)piperidine-4-carboxylate Traditional Name: 1-(3-phenylpropyl)-4-(N-propionylanilino)isonipecotic acid methyl ester Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C25H32N2O3/c1-3-23(28)27(22-14-8-5-9-15-22)25(24(29)30-2)16-19-26(20-17-25)18-10-13-21-11-6-4-7-12-21/h4-9,11-12,14-15H,3,10,13,16-20H2,1-2H3