5-(2-ethylhexanoylamino)-N-(2-methylpropyl)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide

Systemtic Name: 5-(2-ethylhexanoylamino)-N-(2-methylpropyl)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-5-(2-ethylhexanoylamino)-N-isobutyl-benzamide CAS Name: 5-[(2-ethyl-1-oxohexyl)amino]-N-(2-methylpropyl)-2-[4-(phenylmethyl)-1-piperidinyl]benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-(2-ethylhexanoylamino)-N-(2-methylpropyl)benzamide Traditional Name: 2-(4-benzylpiperidino)-5-(2-ethylhexanoylamino)-N-isobutyl-benzamide Formula: C31H45N3O2 MolecularWeight: 491.7079

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NCC(C)C

Isomeric SMILES

CCCCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NCC(C)C

InChI

InChI=1S/C31H45N3O2/c1-5-7-13-26(6-2)30(35)33-27-14-15-29(28(21-27)31(36)32-22-23(3)4)34-18-16-25(17-19-34)20-24-11-9-8-10-12-24/h8-12,14-15,21,23,25-26H,5-7,13,16-20,22H2,1-4H3,(H,32,36)(H,33,35)