5-methoxy-2-[(E)-2-oxidanidyl-4-oxidanylidene-pent-2-en-3-yl]benzoate

Systemtic Name: 5-methoxy-2-[(E)-2-oxidanidyl-4-oxidanylidene-pent-2-en-3-yl]benzoate Openeye Name: 2-[(E)-1-acetyl-2-oxido-prop-1-enyl]-5-methoxy-benzoate CAS Name: 5-methoxy-2-[(E)-2-oxido-4-oxopent-2-en-3-yl]benzoate IUPAC Name: 5-methoxy-2-[(E)-2-oxido-4-oxopent-2-en-3-yl]benzoate Traditional Name: 2-[(E)-1-acetyl-2-oxido-prop-1-enyl]-5-methoxy-benzoate Formula: C13H12O5-2 MolecularWeight: 248.23138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=C(/C1=C(C=C(C=C1)OC)C(=O)[O-])\C(=O)C)/[O-]

InChI

InChI=1S/C13H14O5/c1-7(14)12(8(2)15)10-5-4-9(18-3)6-11(10)13(16)17/h4-6,14H,1-3H3,(H,16,17)/p-2/b12-7-