4-(2-cyanoethanoylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide

Systemtic Name: 4-(2-cyanoethanoylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide Openeye Name: 4-[(2-cyanoacetyl)amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide CAS Name: 4-[(2-cyano-1-oxoethyl)amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide IUPAC Name: 4-[(2-cyanoacetyl)amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide Traditional Name: 4-[(2-cyanoacetyl)amino]-N-homoveratryl-benzamide Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)NC(=O)CC#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)NC(=O)CC#N)OC

InChI

InChI=1S/C20H21N3O4/c1-26-17-8-3-14(13-18(17)27-2)10-12-22-20(25)15-4-6-16(7-5-15)23-19(24)9-11-21/h3-8,13H,9-10,12H2,1-2H3,(H,22,25)(H,23,24)