sodium (2E,4E)-5-(1,3-benzodioxol-5-yl)-3-methyl-penta-2,4-dienoate

Systemtic Name: sodium (2E,4E)-5-(1,3-benzodioxol-5-yl)-3-methyl-penta-2,4-dienoate Openeye Name: sodium (2E,4E)-5-(1,3-benzodioxol-5-yl)-3-methyl-penta-2,4-dienoate CAS Name: sodium (2E,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoate IUPAC Name: sodium (2E,4E)-5-(1,3-benzodioxol-5-yl)-3-methylpenta-2,4-dienoate Traditional Name: sodium (2E,4E)-5-(1,3-benzodioxol-5-yl)-3-methyl-penta-2,4-dienoate Formula: C13H11NaO4 MolecularWeight: 254.21381

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)[O-])C=CC1=CC2=C(C=C1)OCO2.[Na+]

Isomeric SMILES

C/C(=C\C(=O)[O-])/C=C/C1=CC2=C(C=C1)OCO2.[Na+]

InChI

InChI=1S/C13H12O4.Na/c1-9(6-13(14)15)2-3-10-4-5-11-12(7-10)17-8-16-11;/h2-7H,8H2,1H3,(H,14,15);/q;+1/p-1/b3-2+,9-6+;