(3-azanyl-3-oxidanylidene-1-pyridin-2-yl-propyl) ethanesulfonate

Systemtic Name: (3-azanyl-3-oxidanylidene-1-pyridin-2-yl-propyl) ethanesulfonate Openeye Name: [3-amino-3-oxo-1-(2-pyridyl)propyl] ethanesulfonate CAS Name: ethanesulfonic acid [3-amino-3-oxo-1-(2-pyridinyl)propyl] ester IUPAC Name: (3-amino-3-oxo-1-pyridin-2-ylpropyl) ethanesulfonate Traditional Name: ethanesulfonic acid [3-amino-3-keto-1-(2-pyridyl)propyl] ester Formula: C10H14N2O4S MolecularWeight: 258.29416

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC(CC(=O)N)C1=CC=CC=N1

Isomeric SMILES

CCS(=O)(=O)OC(CC(=O)N)C1=CC=CC=N1

InChI

InChI=1S/C10H14N2O4S/c1-2-17(14,15)16-9(7-10(11)13)8-5-3-4-6-12-8/h3-6,9H,2,7H2,1H3,(H2,11,13)