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

Systemtic Name: sodium (E)-3-[4-[2,3-bis(oxidanyl)propanoyloxy]-3-methoxy-phenyl]prop-2-enoate Openeye Name: sodium (E)-3-[4-(2,3-dihydroxypropanoyloxy)-3-methoxy-phenyl]prop-2-enoate CAS Name: sodium (E)-3-[4-(2,3-dihydroxy-1-oxopropoxy)-3-methoxyphenyl]-2-propenoate IUPAC Name: sodium (E)-3-[4-(2,3-dihydroxypropanoyloxy)-3-methoxyphenyl]prop-2-enoate Traditional Name: sodium (E)-3-(4-glyceroyloxy-3-methoxy-phenyl)acrylate Formula: C13H13NaO7 MolecularWeight: 304.22789

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)[O-])OC(=O)C(CO)O.[Na+]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)[O-])OC(=O)C(CO)O.[Na+]

InChI

InChI=1S/C13H14O7.Na/c1-19-11-6-8(3-5-12(16)17)2-4-10(11)20-13(18)9(15)7-14;/h2-6,9,14-15H,7H2,1H3,(H,16,17);/q;+1/p-1/b5-3+;