propan-2-yl 1-phenethyl-4-[phenyl(propanoyl)amino]piperidine-4-carboxylate

Systemtic Name: propan-2-yl 1-phenethyl-4-[phenyl(propanoyl)amino]piperidine-4-carboxylate Openeye Name: isopropyl 1-phenethyl-4-(N-propanoylanilino)piperidine-4-carboxylate CAS Name: 4-[N-(1-oxopropyl)anilino]-1-phenethyl-4-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-phenethyl-4-(N-propanoylanilino)piperidine-4-carboxylate Traditional Name: 1-phenethyl-4-(N-propionylanilino)isonipecotic acid isopropyl ester Formula: C26H34N2O3 MolecularWeight: 422.55976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCC3=CC=CC=C3)C(=O)OC(C)C

Isomeric SMILES

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCC3=CC=CC=C3)C(=O)OC(C)C

InChI

InChI=1S/C26H34N2O3/c1-4-24(29)28(23-13-9-6-10-14-23)26(25(30)31-21(2)3)16-19-27(20-17-26)18-15-22-11-7-5-8-12-22/h5-14,21H,4,15-20H2,1-3H3