N-[1-(cyanomethylamino)-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[1-(cyanomethylamino)-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-3,4-dimethoxy-benzamide Openeye Name: N-[2-(cyanomethylamino)-1-(cyclohexylmethyl)-2-oxo-ethyl]-3,4-dimethoxy-benzamide CAS Name: N-[1-(cyanomethylamino)-3-cyclohexyl-1-oxopropan-2-yl]-3,4-dimethoxybenzamide IUPAC Name: N-[1-(cyanomethylamino)-3-cyclohexyl-1-oxopropan-2-yl]-3,4-dimethoxybenzamide Traditional Name: N-[2-(cyanomethylamino)-1-(cyclohexylmethyl)-2-keto-ethyl]-3,4-dimethoxy-benzamide Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(CC2CCCCC2)C(=O)NCC#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(CC2CCCCC2)C(=O)NCC#N)OC

InChI

InChI=1S/C20H27N3O4/c1-26-17-9-8-15(13-18(17)27-2)19(24)23-16(20(25)22-11-10-21)12-14-6-4-3-5-7-14/h8-9,13-14,16H,3-7,11-12H2,1-2H3,(H,22,25)(H,23,24)