methyl 2,3-bis(oxidanyl)-6-phenethyl-benzoate

Systemtic Name: methyl 2,3-bis(oxidanyl)-6-phenethyl-benzoate Openeye Name: methyl 2,3-dihydroxy-6-phenethyl-benzoate CAS Name: 2,3-dihydroxy-6-phenethylbenzoic acid methyl ester IUPAC Name: methyl 2,3-dihydroxy-6-phenethylbenzoate Traditional Name: 2,3-dihydroxy-6-phenethyl-benzoic acid methyl ester Formula: C16H16O4 MolecularWeight: 272.29584

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1O)O)CCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1O)O)CCC2=CC=CC=C2

InChI

InChI=1S/C16H16O4/c1-20-16(19)14-12(9-10-13(17)15(14)18)8-7-11-5-3-2-4-6-11/h2-6,9-10,17-18H,7-8H2,1H3