N-[1-(cyanomethylamino)-5-methyl-1-oxidanylidene-2-piperidin-1-yl-hexan-2-yl]benzamide

Systemtic Name: N-[1-(cyanomethylamino)-5-methyl-1-oxidanylidene-2-piperidin-1-yl-hexan-2-yl]benzamide Openeye Name: N-[1-(cyanomethylcarbamoyl)-4-methyl-1-(1-piperidyl)pentyl]benzamide CAS Name: N-[1-(cyanomethylamino)-5-methyl-1-oxo-2-(1-piperidinyl)hexan-2-yl]benzamide IUPAC Name: N-[1-(cyanomethylamino)-5-methyl-1-oxo-2-piperidin-1-ylhexan-2-yl]benzamide Traditional Name: N-[1-(cyanomethylcarbamoyl)-4-methyl-1-piperidino-pentyl]benzamide Formula: C21H30N4O2 MolecularWeight: 370.4885

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C(=O)NCC#N)(NC(=O)C1=CC=CC=C1)N2CCCCC2

Isomeric SMILES

CC(C)CCC(C(=O)NCC#N)(NC(=O)C1=CC=CC=C1)N2CCCCC2

InChI

InChI=1S/C21H30N4O2/c1-17(2)11-12-21(20(27)23-14-13-22,25-15-7-4-8-16-25)24-19(26)18-9-5-3-6-10-18/h3,5-6,9-10,17H,4,7-8,11-12,14-16H2,1-2H3,(H,23,27)(H,24,26)