3-(4-methylphenyl)-2-oxidanylidene-propanoate

Systemtic Name: 3-(4-methylphenyl)-2-oxidanylidene-propanoate Openeye Name: 2-oxo-3-(p-tolyl)propanoate CAS Name: 3-(4-methylphenyl)-2-oxopropanoate IUPAC Name: 3-(4-methylphenyl)-2-oxopropanoate Traditional Name: 2-keto-3-(p-tolyl)propionate Formula: C10H9O3- MolecularWeight: 177.17666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(=O)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CC(=O)C(=O)[O-]

InChI

InChI=1S/C10H10O3/c1-7-2-4-8(5-3-7)6-9(11)10(12)13/h2-5H,6H2,1H3,(H,12,13)/p-1