N-(2-azanylcyclohexyl)-3-(2-phenylethanoylamino)-4-[[4-(phenylmethyl)piperidin-1-yl]methyl]benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-3-(2-phenylethanoylamino)-4-[[4-(phenylmethyl)piperidin-1-yl]methyl]benzamide Openeye Name: N-(2-aminocyclohexyl)-4-[(4-benzyl-1-piperidyl)methyl]-3-[(2-phenylacetyl)amino]benzamide CAS Name: N-(2-aminocyclohexyl)-3-[(1-oxo-2-phenylethyl)amino]-4-[[4-(phenylmethyl)-1-piperidinyl]methyl]benzamide IUPAC Name: N-(2-aminocyclohexyl)-4-[(4-benzylpiperidin-1-yl)methyl]-3-[(2-phenylacetyl)amino]benzamide Traditional Name: N-(2-aminocyclohexyl)-4-[(4-benzylpiperidino)methyl]-3-[(2-phenylacetyl)amino]benzamide Formula: C34H42N4O2 MolecularWeight: 538.72288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)NC(=O)C2=CC(=C(C=C2)CN3CCC(CC3)CC4=CC=CC=C4)NC(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CCC(C(C1)N)NC(=O)C2=CC(=C(C=C2)CN3CCC(CC3)CC4=CC=CC=C4)NC(=O)CC5=CC=CC=C5

InChI

InChI=1S/C34H42N4O2/c35-30-13-7-8-14-31(30)37-34(40)28-15-16-29(32(23-28)36-33(39)22-26-11-5-2-6-12-26)24-38-19-17-27(18-20-38)21-25-9-3-1-4-10-25/h1-6,9-12,15-16,23,27,30-31H,7-8,13-14,17-22,24,35H2,(H,36,39)(H,37,40)