4-[[[2-[2-cyanoethyl-(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[[2-[2-cyanoethyl-(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[[2-[N-(2-cyanoethyl)-2-methoxy-anilino]-2-oxo-ethyl]-methyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[[2-[N-(2-cyanoethyl)-2-methoxyanilino]-2-oxoethyl]-methylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[[2-[N-(2-cyanoethyl)-2-methoxyanilino]-2-oxoethyl]-methylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[[2-[N-(2-cyanoethyl)-2-methoxy-anilino]-2-keto-ethyl]-methyl-amino]methyl]-N-methyl-benzamide Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(C)CC(=O)N(CCC#N)C2=CC=CC=C2OC

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(C)CC(=O)N(CCC#N)C2=CC=CC=C2OC

InChI

InChI=1S/C22H26N4O3/c1-24-22(28)18-11-9-17(10-12-18)15-25(2)16-21(27)26(14-6-13-23)19-7-4-5-8-20(19)29-3/h4-5,7-12H,6,14-16H2,1-3H3,(H,24,28)