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

Systemtic Name: [1-(3-azanylpropyl)-4-methyl-2-oxidanyl-6-oxidanylidene-pyridin-3-yl]methanesulfonic acid Openeye Name: [1-(3-aminopropyl)-2-hydroxy-4-methyl-6-oxo-3-pyridyl]methanesulfonic acid CAS Name: [1-(3-aminopropyl)-2-hydroxy-4-methyl-6-oxo-3-pyridinyl]methanesulfonic acid IUPAC Name: [1-(3-aminopropyl)-2-hydroxy-4-methyl-6-oxopyridin-3-yl]methanesulfonic acid Traditional Name: [1-(3-aminopropyl)-2-hydroxy-6-keto-4-methyl-3-pyridyl]methanesulfonic acid Formula: C10H16N2O5S MolecularWeight: 276.30944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=C1CS(=O)(=O)O)O)CCCN

Isomeric SMILES

CC1=CC(=O)N(C(=C1CS(=O)(=O)O)O)CCCN

InChI

InChI=1S/C10H16N2O5S/c1-7-5-9(13)12(4-2-3-11)10(14)8(7)6-18(15,16)17/h5,14H,2-4,6,11H2,1H3,(H,15,16,17)