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

Systemtic Name: methyl 1-heptyl-4-[phenyl(propanoyl)amino]piperidine-4-carboxylate Openeye Name: methyl 1-heptyl-4-(N-propanoylanilino)piperidine-4-carboxylate CAS Name: 1-heptyl-4-[N-(1-oxopropyl)anilino]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-heptyl-4-(N-propanoylanilino)piperidine-4-carboxylate Traditional Name: 1-heptyl-4-(N-propionylanilino)isonipecotic acid methyl ester Formula: C23H36N2O3 MolecularWeight: 388.54354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1CCC(CC1)(C(=O)OC)N(C2=CC=CC=C2)C(=O)CC

Isomeric SMILES

CCCCCCCN1CCC(CC1)(C(=O)OC)N(C2=CC=CC=C2)C(=O)CC

InChI

InChI=1S/C23H36N2O3/c1-4-6-7-8-12-17-24-18-15-23(16-19-24,22(27)28-3)25(21(26)5-2)20-13-10-9-11-14-20/h9-11,13-14H,4-8,12,15-19H2,1-3H3