[3-methoxy-4-(5-oxidanylidene-1,4-dihydroimidazo[4,5-b]pyridin-2-yl)phenyl] ethanesulfonate

Systemtic Name: [3-methoxy-4-(5-oxidanylidene-1,4-dihydroimidazo[4,5-b]pyridin-2-yl)phenyl] ethanesulfonate Openeye Name: [3-methoxy-4-(5-oxo-1,4-dihydroimidazo[4,5-b]pyridin-2-yl)phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [3-methoxy-4-(5-oxo-1,4-dihydroimidazo[4,5-b]pyridin-2-yl)phenyl] ester IUPAC Name: [3-methoxy-4-(5-oxo-1,4-dihydroimidazo[4,5-b]pyridin-2-yl)phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [4-(5-keto-1,4-dihydroimidazo[4,5-b]pyridin-2-yl)-3-methoxy-phenyl] ester Formula: C15H15N3O5S MolecularWeight: 349.3617

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CC(=C(C=C1)C2=NC3=C(N2)C=CC(=O)N3)OC

Isomeric SMILES

CCS(=O)(=O)OC1=CC(=C(C=C1)C2=NC3=C(N2)C=CC(=O)N3)OC

InChI

InChI=1S/C15H15N3O5S/c1-3-24(20,21)23-9-4-5-10(12(8-9)22-2)14-16-11-6-7-13(19)17-15(11)18-14/h4-8H,3H2,1-2H3,(H2,16,17,18,19)