(3S)-N-[2-(4-ethoxyphenoxy)phenyl]-1-(4-fluorophenyl)carbonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-[2-(4-ethoxyphenoxy)phenyl]-1-(4-fluorophenyl)carbonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-[2-(4-ethoxyphenoxy)phenyl]-1-(4-fluorobenzoyl)piperidine-3-carboxamide CAS Name: (3S)-N-[2-(4-ethoxyphenoxy)phenyl]-1-[(4-fluorophenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-[2-(4-ethoxyphenoxy)phenyl]-1-(4-fluorobenzoyl)piperidine-3-carboxamide Traditional Name: (3S)-N-[2-(4-ethoxyphenoxy)phenyl]-1-(4-fluorobenzoyl)nipecotamide Formula: C27H27FN2O4 MolecularWeight: 462.512683

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)C3CCCN(C3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)[C@H]3CCCN(C3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H27FN2O4/c1-2-33-22-13-15-23(16-14-22)34-25-8-4-3-7-24(25)29-26(31)20-6-5-17-30(18-20)27(32)19-9-11-21(28)12-10-19/h3-4,7-16,20H,2,5-6,17-18H2,1H3,(H,29,31)/t20-/m0/s1