(E)-3-[1-(2-cyanoethyl)indol-3-yl]-N-[(4-methylphenyl)methyl]prop-2-enamide

Systemtic Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-N-[(4-methylphenyl)methyl]prop-2-enamide Openeye Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-N-(p-tolylmethyl)prop-2-enamide CAS Name: (E)-3-[1-(2-cyanoethyl)-3-indolyl]-N-[(4-methylphenyl)methyl]-2-propenamide IUPAC Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-N-[(4-methylphenyl)methyl]prop-2-enamide Traditional Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-N-(4-methylbenzyl)acrylamide Formula: C22H21N3O MolecularWeight: 343.42164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C=CC2=CN(C3=CC=CC=C32)CCC#N

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)/C=C/C2=CN(C3=CC=CC=C32)CCC#N

InChI

InChI=1S/C22H21N3O/c1-17-7-9-18(10-8-17)15-24-22(26)12-11-19-16-25(14-4-13-23)21-6-3-2-5-20(19)21/h2-3,5-12,16H,4,14-15H2,1H3,(H,24,26)/b12-11+