(E)-3-[3,4-bis(oxidanyl)-2-phenethyl-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3,4-bis(oxidanyl)-2-phenethyl-phenyl]prop-2-enoic acid Openeye Name: (E)-3-(3,4-dihydroxy-2-phenethyl-phenyl)prop-2-enoic acid CAS Name: (E)-3-(3,4-dihydroxy-2-phenethylphenyl)-2-propenoic acid IUPAC Name: (E)-3-(3,4-dihydroxy-2-phenethylphenyl)prop-2-enoic acid Traditional Name: (E)-3-(3,4-dihydroxy-2-phenethyl-phenyl)acrylic acid Formula: C17H16O4 MolecularWeight: 284.30654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=C(C=CC(=C2O)O)C=CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC2=C(C=CC(=C2O)O)/C=C/C(=O)O

InChI

InChI=1S/C17H16O4/c18-15-10-7-13(8-11-16(19)20)14(17(15)21)9-6-12-4-2-1-3-5-12/h1-5,7-8,10-11,18,21H,6,9H2,(H,19,20)/b11-8+