2-piperidin-1-yl-N-(pyridin-3-ylmethyl)-5-(3,5,5-trimethylhexanoylamino)benzamide

Systemtic Name: 2-piperidin-1-yl-N-(pyridin-3-ylmethyl)-5-(3,5,5-trimethylhexanoylamino)benzamide Openeye Name: 2-(1-piperidyl)-N-(3-pyridylmethyl)-5-(3,5,5-trimethylhexanoylamino)benzamide CAS Name: 2-(1-piperidinyl)-N-(3-pyridinylmethyl)-5-[(3,5,5-trimethyl-1-oxohexyl)amino]benzamide IUPAC Name: 2-piperidin-1-yl-N-(pyridin-3-ylmethyl)-5-(3,5,5-trimethylhexanoylamino)benzamide Traditional Name: 2-piperidino-N-(3-pyridylmethyl)-5-(3,5,5-trimethylhexanoylamino)benzamide Formula: C27H38N4O2 MolecularWeight: 450.61622

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC(=C(C=C1)N2CCCCC2)C(=O)NCC3=CN=CC=C3)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)NC1=CC(=C(C=C1)N2CCCCC2)C(=O)NCC3=CN=CC=C3)CC(C)(C)C

InChI

InChI=1S/C27H38N4O2/c1-20(17-27(2,3)4)15-25(32)30-22-10-11-24(31-13-6-5-7-14-31)23(16-22)26(33)29-19-21-9-8-12-28-18-21/h8-12,16,18,20H,5-7,13-15,17,19H2,1-4H3,(H,29,33)(H,30,32)