[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] (E)-3-(2-methylphenyl)prop-2-enoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] (E)-3-(2-methylphenyl)prop-2-enoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] (E)-3-(o-tolyl)prop-2-enoate CAS Name: (E)-3-(2-methylphenyl)-2-propenoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] (E)-3-(2-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(o-tolyl)acrylic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=CC(=O)OCC(=O)NCCC#N

Isomeric SMILES

CC1=CC=CC=C1/C=C/C(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C15H16N2O3/c1-12-5-2-3-6-13(12)7-8-15(19)20-11-14(18)17-10-4-9-16/h2-3,5-8H,4,10-11H2,1H3,(H,17,18)/b8-7+