[2-[2-cyanoethyl(phenyl)amino]-2-oxidanylidene-ethyl] (2E,4E)-hexa-2,4-dienoate

Systemtic Name: [2-[2-cyanoethyl(phenyl)amino]-2-oxidanylidene-ethyl] (2E,4E)-hexa-2,4-dienoate Openeye Name: [2-[N-(2-cyanoethyl)anilino]-2-oxo-ethyl] (2E,4E)-hexa-2,4-dienoate CAS Name: (2E,4E)-hexa-2,4-dienoic acid [2-[N-(2-cyanoethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[N-(2-cyanoethyl)anilino]-2-oxoethyl] (2E,4E)-hexa-2,4-dienoate Traditional Name: (2E,4E)-hexa-2,4-dienoic acid [2-[N-(2-cyanoethyl)anilino]-2-keto-ethyl] ester Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)OCC(=O)N(CCC#N)C1=CC=CC=C1

Isomeric SMILES

C/C=C/C=C/C(=O)OCC(=O)N(CCC#N)C1=CC=CC=C1

InChI

InChI=1S/C17H18N2O3/c1-2-3-5-11-17(21)22-14-16(20)19(13-8-12-18)15-9-6-4-7-10-15/h2-7,9-11H,8,13-14H2,1H3/b3-2+,11-5+