methyl 4-[(E)-3-(cyanomethoxy)-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-(cyanomethoxy)-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-(cyanomethoxy)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-(cyanomethoxy)-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-(cyanomethoxy)-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-(cyanomethoxy)-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C13H11NO4 MolecularWeight: 245.23074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11NO4/c1-17-13(16)11-5-2-10(3-6-11)4-7-12(15)18-9-8-14/h2-7H,9H2,1H3/b7-4+