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

Systemtic Name: methyl 4-[(E)-2-cyano-3-oxidanylidene-3-(prop-2-enylamino)prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-(allylamino)-2-cyano-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-2-cyano-3-oxo-3-(prop-2-enylamino)prop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2-cyano-3-oxo-3-(prop-2-enylamino)prop-1-enyl]benzoate Traditional Name: 4-[(E)-3-(allylamino)-2-cyano-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C15H14N2O3 MolecularWeight: 270.28326

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C(C#N)C(=O)NCC=C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)NCC=C

InChI

InChI=1S/C15H14N2O3/c1-3-8-17-14(18)13(10-16)9-11-4-6-12(7-5-11)15(19)20-2/h3-7,9H,1,8H2,2H3,(H,17,18)/b13-9+