sodium (E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoate

Systemtic Name: sodium (E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoate Openeye Name: sodium (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate CAS Name: sodium (E)-3-(3,4-dihydroxyphenyl)-2-propenoate IUPAC Name: sodium (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate Traditional Name: sodium (E)-3-(3,4-dihydroxyphenyl)acrylate Formula: C9H7NaO4 MolecularWeight: 202.13925

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=CC(=O)[O-])O)O.[Na+]

Isomeric SMILES

C1=CC(=C(C=C1/C=C/C(=O)[O-])O)O.[Na+]

InChI

InChI=1S/C9H8O4.Na/c10-7-3-1-6(5-8(7)11)2-4-9(12)13;/h1-5,10-11H,(H,12,13);/q;+1/p-1/b4-2+;