N-[(2S)-butan-2-yl]-2-piperidin-1-yl-5-[[(3R)-3,5,5-trimethylhexanoyl]amino]benzamide

Systemtic Name: N-[(2S)-butan-2-yl]-2-piperidin-1-yl-5-[[(3R)-3,5,5-trimethylhexanoyl]amino]benzamide Openeye Name: N-[(1S)-1-methylpropyl]-2-(1-piperidyl)-5-[[(3R)-3,5,5-trimethylhexanoyl]amino]benzamide CAS Name: N-[(2S)-butan-2-yl]-2-(1-piperidinyl)-5-[[(3R)-3,5,5-trimethyl-1-oxohexyl]amino]benzamide IUPAC Name: N-[(2S)-butan-2-yl]-2-piperidin-1-yl-5-[[(3R)-3,5,5-trimethylhexanoyl]amino]benzamide Traditional Name: N-[(1S)-1-methylpropyl]-2-piperidino-5-[[(3R)-3,5,5-trimethylhexanoyl]amino]benzamide Formula: C25H41N3O2 MolecularWeight: 415.61194

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)CC(C)CC(C)(C)C)N2CCCCC2

Isomeric SMILES

CC[C@H](C)NC(=O)C1=C(C=CC(=C1)NC(=O)C[C@H](C)CC(C)(C)C)N2CCCCC2

InChI

InChI=1S/C25H41N3O2/c1-7-19(3)26-24(30)21-16-20(11-12-22(21)28-13-9-8-10-14-28)27-23(29)15-18(2)17-25(4,5)6/h11-12,16,18-19H,7-10,13-15,17H2,1-6H3,(H,26,30)(H,27,29)/t18-,19-/m0/s1