3-(2-ethanoyl-3-methoxy-4-oxidanyl-phenyl)prop-2-enoic acid

Systemtic Name: 3-(2-ethanoyl-3-methoxy-4-oxidanyl-phenyl)prop-2-enoic acid Openeye Name: 3-(2-acetyl-4-hydroxy-3-methoxy-phenyl)prop-2-enoic acid CAS Name: 3-(2-acetyl-4-hydroxy-3-methoxyphenyl)-2-propenoic acid IUPAC Name: 3-(2-acetyl-4-hydroxy-3-methoxyphenyl)prop-2-enoic acid Traditional Name: 3-(2-acetyl-4-hydroxy-3-methoxy-phenyl)acrylic acid Formula: C12H12O5 MolecularWeight: 236.22068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1OC)O)C=CC(=O)O

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1OC)O)C=CC(=O)O

InChI

InChI=1S/C12H12O5/c1-7(13)11-8(4-6-10(15)16)3-5-9(14)12(11)17-2/h3-6,14H,1-2H3,(H,15,16)