methyl 4-[(E)-2-cyano-3-oxidanylidene-3-(propan-2-ylamino)prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-2-cyano-3-oxidanylidene-3-(propan-2-ylamino)prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-2-cyano-3-(isopropylamino)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-2-cyano-3-oxo-3-(propan-2-ylamino)prop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2-cyano-3-oxo-3-(propan-2-ylamino)prop-1-enyl]benzoate Traditional Name: 4-[(E)-2-cyano-3-(isopropylamino)-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC1=CC=C(C=C1)C(=O)OC)C#N

Isomeric SMILES

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

InChI

InChI=1S/C15H16N2O3/c1-10(2)17-14(18)13(9-16)8-11-4-6-12(7-5-11)15(19)20-3/h4-8,10H,1-3H3,(H,17,18)/b13-8+