(E)-5-[3-(carboxymethyl)phenyl]-3-oxidanylidene-pent-4-enoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12O5/c14-11(8-13(17)18)5-4-9-2-1-3-10(6-9)7-12(15)16/h1-6H,7-8H2,(H,15,16)(H,17,18)/b5-4+