[5-(1-azanylethyl)-4-methyl-2-oxidanyl-6-oxidanylidene-1H-pyridin-3-yl]methanesulfonic acid

Systemtic Name: [5-(1-azanylethyl)-4-methyl-2-oxidanyl-6-oxidanylidene-1H-pyridin-3-yl]methanesulfonic acid Openeye Name: [5-(1-aminoethyl)-2-hydroxy-4-methyl-6-oxo-1H-pyridin-3-yl]methanesulfonic acid CAS Name: [5-(1-aminoethyl)-2-hydroxy-4-methyl-6-oxo-1H-pyridin-3-yl]methanesulfonic acid IUPAC Name: [5-(1-aminoethyl)-2-hydroxy-4-methyl-6-oxo-1H-pyridin-3-yl]methanesulfonic acid Traditional Name: [5-(1-aminoethyl)-2-hydroxy-6-keto-4-methyl-1H-pyridin-3-yl]methanesulfonic acid Formula: C9H14N2O5S MolecularWeight: 262.28286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1CS(=O)(=O)O)O)C(C)N

Isomeric SMILES

CC1=C(C(=O)NC(=C1CS(=O)(=O)O)O)C(C)N

InChI

InChI=1S/C9H14N2O5S/c1-4-6(3-17(14,15)16)8(12)11-9(13)7(4)5(2)10/h5H,3,10H2,1-2H3,(H2,11,12,13)(H,14,15,16)