2-[(E)-6-oxidanyl-3,6-bis(oxidanylidene)hex-1-enyl]benzoic acid

Systemtic Name: 2-[(E)-6-oxidanyl-3,6-bis(oxidanylidene)hex-1-enyl]benzoic acid Openeye Name: 2-[(E)-6-hydroxy-3,6-dioxo-hex-1-enyl]benzoic acid CAS Name: 2-[(E)-6-hydroxy-3,6-dioxohex-1-enyl]benzoic acid IUPAC Name: 2-[(E)-6-hydroxy-3,6-dioxohex-1-enyl]benzoic acid Traditional Name: 2-[(E)-6-hydroxy-3,6-diketo-hex-1-enyl]benzoic acid Formula: C13H12O5 MolecularWeight: 248.23138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12O5/c14-10(7-8-12(15)16)6-5-9-3-1-2-4-11(9)13(17)18/h1-6H,7-8H2,(H,15,16)(H,17,18)/b6-5+