N-[1-(cyanomethylamino)-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-3-ethanoyl-benzamide

Systemtic Name: N-[1-(cyanomethylamino)-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-3-ethanoyl-benzamide Openeye Name: 3-acetyl-N-[2-(cyanomethylamino)-1-(cyclohexylmethyl)-2-oxo-ethyl]benzamide CAS Name: 3-acetyl-N-[1-(cyanomethylamino)-3-cyclohexyl-1-oxopropan-2-yl]benzamide IUPAC Name: 3-acetyl-N-[1-(cyanomethylamino)-3-cyclohexyl-1-oxopropan-2-yl]benzamide Traditional Name: 3-acetyl-N-[2-(cyanomethylamino)-1-(cyclohexylmethyl)-2-keto-ethyl]benzamide Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)C(=O)NC(CC2CCCCC2)C(=O)NCC#N

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)C(=O)NC(CC2CCCCC2)C(=O)NCC#N

InChI

InChI=1S/C20H25N3O3/c1-14(24)16-8-5-9-17(13-16)19(25)23-18(20(26)22-11-10-21)12-15-6-3-2-4-7-15/h5,8-9,13,15,18H,2-4,6-7,11-12H2,1H3,(H,22,26)(H,23,25)