5-(hexanoylamino)-2-[4-(phenylmethyl)piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 5-(hexanoylamino)-2-[4-(phenylmethyl)piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-5-(hexanoylamino)-N-(3-pyridylmethyl)benzamide CAS Name: 5-(1-oxohexylamino)-2-[4-(phenylmethyl)-1-piperidinyl]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-(hexanoylamino)-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 2-(4-benzylpiperidino)-5-(caproylamino)-N-(3-pyridylmethyl)benzamide Formula: C31H38N4O2 MolecularWeight: 498.65902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CCCCCC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C31H38N4O2/c1-2-3-5-12-30(36)34-27-13-14-29(28(21-27)31(37)33-23-26-11-8-17-32-22-26)35-18-15-25(16-19-35)20-24-9-6-4-7-10-24/h4,6-11,13-14,17,21-22,25H,2-3,5,12,15-16,18-20,23H2,1H3,(H,33,37)(H,34,36)