1-[(2-chloranyl-5-methylsulfonyl-phenyl)methyl]-3-nitro-2-oxidanyl-pyridin-4-one

Systemtic Name: 1-[(2-chloranyl-5-methylsulfonyl-phenyl)methyl]-3-nitro-2-oxidanyl-pyridin-4-one Openeye Name: 1-[(2-chloro-5-methylsulfonyl-phenyl)methyl]-2-hydroxy-3-nitro-pyridin-4-one CAS Name: 1-[(2-chloro-5-methylsulfonylphenyl)methyl]-2-hydroxy-3-nitro-4-pyridinone IUPAC Name: 1-[(2-chloro-5-methylsulfonylphenyl)methyl]-2-hydroxy-3-nitropyridin-4-one Traditional Name: 1-(2-chloro-5-mesyl-benzyl)-2-hydroxy-3-nitro-4-pyridone Formula: C13H11ClN2O6S MolecularWeight: 358.75424

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)CN2C=CC(=O)C(=C2O)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)CN2C=CC(=O)C(=C2O)[N+](=O)[O-]

InChI

InChI=1S/C13H11ClN2O6S/c1-23(21,22)9-2-3-10(14)8(6-9)7-15-5-4-11(17)12(13(15)18)16(19)20/h2-6,18H,7H2,1H3