N-[2-[[4-(2-cyanopropan-2-yl)phenyl]amino]-2-oxidanylidene-ethyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[2-[[4-(2-cyanopropan-2-yl)phenyl]amino]-2-oxidanylidene-ethyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[2-[4-(1-cyano-1-methyl-ethyl)anilino]-2-oxo-ethyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[2-[4-(2-cyanopropan-2-yl)anilino]-2-oxoethyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[2-[4-(2-cyanopropan-2-yl)anilino]-2-oxoethyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[2-[4-(1-cyano-1-methyl-ethyl)anilino]-2-keto-ethyl]-3,4,5-trimethoxy-benzamide Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC=C(C=C1)NC(=O)CNC(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CC(C)(C#N)C1=CC=C(C=C1)NC(=O)CNC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C22H25N3O5/c1-22(2,13-23)15-6-8-16(9-7-15)25-19(26)12-24-21(27)14-10-17(28-3)20(30-5)18(11-14)29-4/h6-11H,12H2,1-5H3,(H,24,27)(H,25,26)