[1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] (2E,4E)-hexa-2,4-dienoate

Systemtic Name: [1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] (2E,4E)-hexa-2,4-dienoate Openeye Name: [2-(3-cyanoanilino)-1-methyl-2-oxo-ethyl] (2E,4E)-hexa-2,4-dienoate CAS Name: (2E,4E)-hexa-2,4-dienoic acid [1-(3-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-cyanoanilino)-1-oxopropan-2-yl] (2E,4E)-hexa-2,4-dienoate Traditional Name: (2E,4E)-hexa-2,4-dienoic acid [2-(3-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)OC(C)C(=O)NC1=CC=CC(=C1)C#N

Isomeric SMILES

C/C=C/C=C/C(=O)OC(C)C(=O)NC1=CC=CC(=C1)C#N

InChI

InChI=1S/C16H16N2O3/c1-3-4-5-9-15(19)21-12(2)16(20)18-14-8-6-7-13(10-14)11-17/h3-10,12H,1-2H3,(H,18,20)/b4-3+,9-5+