N-cyclopropyl-5-(3-methylbutanoylamino)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide

Systemtic Name: N-cyclopropyl-5-(3-methylbutanoylamino)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-N-cyclopropyl-5-(3-methylbutanoylamino)benzamide CAS Name: N-cyclopropyl-5-[(3-methyl-1-oxobutyl)amino]-2-[4-(phenylmethyl)-1-piperidinyl]benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-N-cyclopropyl-5-(3-methylbutanoylamino)benzamide Traditional Name: 2-(4-benzylpiperidino)-N-cyclopropyl-5-(isovalerylamino)benzamide Formula: C27H35N3O2 MolecularWeight: 433.5857

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NC4CC4

Isomeric SMILES

CC(C)CC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NC4CC4

InChI

InChI=1S/C27H35N3O2/c1-19(2)16-26(31)28-23-10-11-25(24(18-23)27(32)29-22-8-9-22)30-14-12-21(13-15-30)17-20-6-4-3-5-7-20/h3-7,10-11,18-19,21-22H,8-9,12-17H2,1-2H3,(H,28,31)(H,29,32)