(3S)-1-(4-butoxy-3-ethoxy-phenyl)carbonyl-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-butoxy-3-ethoxy-phenyl)carbonyl-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-1-(4-butoxy-3-ethoxy-benzoyl)-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-1-[(4-butoxy-3-ethoxyphenyl)-oxomethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-butoxy-3-ethoxybenzoyl)-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-1-(4-butoxy-3-ethoxy-benzoyl)-N-phenyl-nipecotamide Formula: C25H32N2O4 MolecularWeight: 424.53258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)N2CCC[C@@H](C2)C(=O)NC3=CC=CC=C3)OCC

InChI

InChI=1S/C25H32N2O4/c1-3-5-16-31-22-14-13-19(17-23(22)30-4-2)25(29)27-15-9-10-20(18-27)24(28)26-21-11-7-6-8-12-21/h6-8,11-14,17,20H,3-5,9-10,15-16,18H2,1-2H3,(H,26,28)/t20-/m0/s1