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

Systemtic Name: 4-[(E)-2-cyano-3-(4-methoxyphenyl)-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: 4-[(E)-2-cyano-3-(4-methoxyphenyl)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-2-cyano-3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate IUPAC Name: 4-[(E)-2-cyano-3-(4-methoxyphenyl)-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-2-cyano-3-keto-3-(4-methoxyphenyl)prop-1-enyl]benzoate Formula: C18H12NO4- MolecularWeight: 306.29218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C(=CC2=CC=C(C=C2)C(=O)[O-])C#N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)/C(=C/C2=CC=C(C=C2)C(=O)[O-])/C#N

InChI

InChI=1S/C18H13NO4/c1-23-16-8-6-13(7-9-16)17(20)15(11-19)10-12-2-4-14(5-3-12)18(21)22/h2-10H,1H3,(H,21,22)/p-1/b15-10+