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

Systemtic Name: 5-(octanoylamino)-2-[4-(phenylmethyl)piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-5-(octanoylamino)-N-(3-pyridylmethyl)benzamide CAS Name: 5-(1-oxooctylamino)-2-[4-(phenylmethyl)-1-piperidinyl]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-(octanoylamino)-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 2-(4-benzylpiperidino)-5-(caprylylamino)-N-(3-pyridylmethyl)benzamide Formula: C33H42N4O2 MolecularWeight: 526.71218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H42N4O2/c1-2-3-4-5-9-14-32(38)36-29-15-16-31(30(23-29)33(39)35-25-28-13-10-19-34-24-28)37-20-17-27(18-21-37)22-26-11-7-6-8-12-26/h6-8,10-13,15-16,19,23-24,27H,2-5,9,14,17-18,20-22,25H2,1H3,(H,35,39)(H,36,38)