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

Systemtic Name: 5-(2-ethylhexanoylamino)-2-[4-(phenylmethyl)piperidin-1-yl]-N-propan-2-yl-benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-5-(2-ethylhexanoylamino)-N-isopropyl-benzamide CAS Name: 5-[(2-ethyl-1-oxohexyl)amino]-2-[4-(phenylmethyl)-1-piperidinyl]-N-propan-2-ylbenzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-(2-ethylhexanoylamino)-N-propan-2-ylbenzamide Traditional Name: 2-(4-benzylpiperidino)-5-(2-ethylhexanoylamino)-N-isopropyl-benzamide Formula: C30H43N3O2 MolecularWeight: 477.68132

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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)NC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C30H43N3O2/c1-5-7-13-25(6-2)29(34)32-26-14-15-28(27(21-26)30(35)31-22(3)4)33-18-16-24(17-19-33)20-23-11-9-8-10-12-23/h8-12,14-15,21-22,24-25H,5-7,13,16-20H2,1-4H3,(H,31,35)(H,32,34)