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

Systemtic Name: N-[1-(cyanomethylamino)-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-3-phenoxy-benzamide Openeye Name: N-[2-(cyanomethylamino)-1-(cyclohexylmethyl)-2-oxo-ethyl]-3-phenoxy-benzamide CAS Name: N-[1-(cyanomethylamino)-3-cyclohexyl-1-oxopropan-2-yl]-3-phenoxybenzamide IUPAC Name: N-[1-(cyanomethylamino)-3-cyclohexyl-1-oxopropan-2-yl]-3-phenoxybenzamide Traditional Name: N-[2-(cyanomethylamino)-1-(cyclohexylmethyl)-2-keto-ethyl]-3-phenoxy-benzamide Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NCC#N)NC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)CC(C(=O)NCC#N)NC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C24H27N3O3/c25-14-15-26-24(29)22(16-18-8-3-1-4-9-18)27-23(28)19-10-7-13-21(17-19)30-20-11-5-2-6-12-20/h2,5-7,10-13,17-18,22H,1,3-4,8-9,15-16H2,(H,26,29)(H,27,28)