(3S)-1-(4-fluorophenyl)carbonyl-N-(furan-2-ylmethyl)-N-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-fluorophenyl)carbonyl-N-(furan-2-ylmethyl)-N-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidine-3-carboxamide Openeye Name: (3S)-N-(2-anilino-2-oxo-ethyl)-1-(4-fluorobenzoyl)-N-(2-furylmethyl)piperidine-3-carboxamide CAS Name: (3S)-N-(2-anilino-2-oxoethyl)-1-[(4-fluorophenyl)-oxomethyl]-N-(2-furanylmethyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-(2-anilino-2-oxoethyl)-1-(4-fluorobenzoyl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide Traditional Name: (3S)-N-(2-anilino-2-keto-ethyl)-1-(4-fluorobenzoyl)-N-(2-furfuryl)nipecotamide Formula: C26H26FN3O4 MolecularWeight: 463.500743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)F)C(=O)N(CC3=CC=CO3)CC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CC=C(C=C2)F)C(=O)N(CC3=CC=CO3)CC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C26H26FN3O4/c27-21-12-10-19(11-13-21)25(32)29-14-4-6-20(16-29)26(33)30(17-23-9-5-15-34-23)18-24(31)28-22-7-2-1-3-8-22/h1-3,5,7-13,15,20H,4,6,14,16-18H2,(H,28,31)/t20-/m0/s1