(E)-5-(3-methoxycarbonylphenyl)-3-oxidanylidene-pent-4-enoic acid

Systemtic Name: (E)-5-(3-methoxycarbonylphenyl)-3-oxidanylidene-pent-4-enoic acid Openeye Name: (E)-5-(3-methoxycarbonylphenyl)-3-oxo-pent-4-enoic acid CAS Name: (E)-5-(3-methoxycarbonylphenyl)-3-oxo-4-pentenoic acid IUPAC Name: (E)-5-(3-methoxycarbonylphenyl)-3-oxopent-4-enoic acid Traditional Name: (E)-5-(3-carbomethoxyphenyl)-3-keto-pent-4-enoic acid Formula: C13H12O5 MolecularWeight: 248.23138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12O5/c1-18-13(17)10-4-2-3-9(7-10)5-6-11(14)8-12(15)16/h2-7H,8H2,1H3,(H,15,16)/b6-5+