3-methoxy-4-[[2-(methylperoxymethyl)-2,3-dihydroimidazo[4,5-b]pyridin-1-yl]methyl]benzoic acid

Systemtic Name: 3-methoxy-4-[[2-(methylperoxymethyl)-2,3-dihydroimidazo[4,5-b]pyridin-1-yl]methyl]benzoic acid Openeye Name: 3-methoxy-4-[[2-(methylperoxymethyl)-2,3-dihydroimidazo[4,5-b]pyridin-1-yl]methyl]benzoic acid CAS Name: 3-methoxy-4-[[2-(methyldioxymethyl)-2,3-dihydroimidazo[4,5-b]pyridin-1-yl]methyl]benzoic acid IUPAC Name: 3-methoxy-4-[[2-(methylperoxymethyl)-2,3-dihydroimidazo[4,5-b]pyridin-1-yl]methyl]benzoic acid Traditional Name: 3-methoxy-4-[[2-(methylperoxymethyl)-2,3-dihydroimidazo[4,5-b]pyridin-1-yl]methyl]benzoic acid Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)O)CN2C(NC3=C2C=CC=N3)COOC

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)O)CN2C(NC3=C2C=CC=N3)COOC

InChI

InChI=1S/C17H19N3O5/c1-23-14-8-11(17(21)22)5-6-12(14)9-20-13-4-3-7-18-16(13)19-15(20)10-25-24-2/h3-8,15H,9-10H2,1-2H3,(H,18,19)(H,21,22)