methyl 3-(1H-imidazol-5-ylmethyl)-2,6-bis(oxidanyl)benzoate

Systemtic Name: methyl 3-(1H-imidazol-5-ylmethyl)-2,6-bis(oxidanyl)benzoate Openeye Name: methyl 2,6-dihydroxy-3-(1H-imidazol-5-ylmethyl)benzoate CAS Name: 2,6-dihydroxy-3-(1H-imidazol-5-ylmethyl)benzoic acid methyl ester IUPAC Name: methyl 2,6-dihydroxy-3-(1H-imidazol-5-ylmethyl)benzoate Traditional Name: 2,6-dihydroxy-3-(1H-imidazol-5-ylmethyl)benzoic acid methyl ester Formula: C12H12N2O4 MolecularWeight: 248.23468

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1O)CC2=CN=CN2)O

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1O)CC2=CN=CN2)O

InChI

InChI=1S/C12H12N2O4/c1-18-12(17)10-9(15)3-2-7(11(10)16)4-8-5-13-6-14-8/h2-3,5-6,15-16H,4H2,1H3,(H,13,14)