[(E)-2-methyl-3-oxidanylidene-3-propoxy-prop-1-enyl] benzoate

Systemtic Name: [(E)-2-methyl-3-oxidanylidene-3-propoxy-prop-1-enyl] benzoate Openeye Name: [(E)-2-methyl-3-oxo-3-propoxy-prop-1-enyl] benzoate CAS Name: benzoic acid [(E)-2-methyl-3-oxo-3-propoxyprop-1-enyl] ester IUPAC Name: [(E)-2-methyl-3-oxo-3-propoxyprop-1-enyl] benzoate Traditional Name: benzoic acid [(E)-3-keto-2-methyl-3-propoxy-prop-1-enyl] ester Formula: C14H16O4 MolecularWeight: 248.27444

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(=COC(=O)C1=CC=CC=C1)C

Isomeric SMILES

CCCOC(=O)/C(=C/OC(=O)C1=CC=CC=C1)/C

InChI

InChI=1S/C14H16O4/c1-3-9-17-13(15)11(2)10-18-14(16)12-7-5-4-6-8-12/h4-8,10H,3,9H2,1-2H3/b11-10+