(E)-3-(2,2-dimethyl-4-oxidanylidene-1,3-benzodioxin-7-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(2,2-dimethyl-4-oxidanylidene-1,3-benzodioxin-7-yl)prop-2-enoic acid Openeye Name: (E)-3-(2,2-dimethyl-4-oxo-1,3-benzodioxin-7-yl)prop-2-enoic acid CAS Name: (E)-3-(2,2-dimethyl-4-oxo-1,3-benzodioxin-7-yl)-2-propenoic acid IUPAC Name: (E)-3-(2,2-dimethyl-4-oxo-1,3-benzodioxin-7-yl)prop-2-enoic acid Traditional Name: (E)-3-(4-keto-2,2-dimethyl-1,3-benzodioxin-7-yl)acrylic acid Formula: C13H12O5 MolecularWeight: 248.23138

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2=C(C=CC(=C2)C=CC(=O)O)C(=O)O1)C

Isomeric SMILES

CC1(OC2=C(C=CC(=C2)/C=C/C(=O)O)C(=O)O1)C

InChI

InChI=1S/C13H12O5/c1-13(2)17-10-7-8(4-6-11(14)15)3-5-9(10)12(16)18-13/h3-7H,1-2H3,(H,14,15)/b6-4+