N-phenethyl-2-[4-(phenylmethyl)piperidin-1-yl]-5-(3,5,5-trimethylhexanoylamino)benzamide

Systemtic Name: N-phenethyl-2-[4-(phenylmethyl)piperidin-1-yl]-5-(3,5,5-trimethylhexanoylamino)benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-N-phenethyl-5-(3,5,5-trimethylhexanoylamino)benzamide CAS Name: N-phenethyl-2-[4-(phenylmethyl)-1-piperidinyl]-5-[(3,5,5-trimethyl-1-oxohexyl)amino]benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-N-phenethyl-5-(3,5,5-trimethylhexanoylamino)benzamide Traditional Name: 2-(4-benzylpiperidino)-N-phenethyl-5-(3,5,5-trimethylhexanoylamino)benzamide Formula: C36H47N3O2 MolecularWeight: 553.77728

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NCCC4=CC=CC=C4)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NCCC4=CC=CC=C4)CC(C)(C)C

InChI

InChI=1S/C36H47N3O2/c1-27(26-36(2,3)4)23-34(40)38-31-15-16-33(32(25-31)35(41)37-20-17-28-11-7-5-8-12-28)39-21-18-30(19-22-39)24-29-13-9-6-10-14-29/h5-16,25,27,30H,17-24,26H2,1-4H3,(H,37,41)(H,38,40)