3-[bis(oxidanyl)-phenyl-methyl]-4-[3-(2-methylprop-2-enoyloxy)propyl]-2-oxidanyl-benzoic acid

Systemtic Name: 3-[bis(oxidanyl)-phenyl-methyl]-4-[3-(2-methylprop-2-enoyloxy)propyl]-2-oxidanyl-benzoic acid Openeye Name: 3-[dihydroxy(phenyl)methyl]-2-hydroxy-4-[3-(2-methylprop-2-enoyloxy)propyl]benzoic acid CAS Name: 3-[dihydroxy(phenyl)methyl]-2-hydroxy-4-[3-(2-methyl-1-oxoprop-2-enoxy)propyl]benzoic acid IUPAC Name: 3-[dihydroxy(phenyl)methyl]-2-hydroxy-4-[3-(2-methylprop-2-enoyloxy)propyl]benzoic acid Traditional Name: 3-[dihydroxy(phenyl)methyl]-2-hydroxy-4-(3-methacryloyloxypropyl)benzoic acid Formula: C21H22O7 MolecularWeight: 386.39518

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OCCCC1=C(C(=C(C=C1)C(=O)O)O)C(C2=CC=CC=C2)(O)O

Isomeric SMILES

CC(=C)C(=O)OCCCC1=C(C(=C(C=C1)C(=O)O)O)C(C2=CC=CC=C2)(O)O

InChI

InChI=1S/C21H22O7/c1-13(2)20(25)28-12-6-7-14-10-11-16(19(23)24)18(22)17(14)21(26,27)15-8-4-3-5-9-15/h3-5,8-11,22,26-27H,1,6-7,12H2,2H3,(H,23,24)