3-chloranyl-4-methyl-5-nitro-N-(1-oxidanylbutan-2-yl)benzenesulfonamide

Systemtic Name: 3-chloranyl-4-methyl-5-nitro-N-(1-oxidanylbutan-2-yl)benzenesulfonamide Openeye Name: 3-chloro-N-[1-(hydroxymethyl)propyl]-4-methyl-5-nitro-benzenesulfonamide CAS Name: 3-chloro-N-(1-hydroxybutan-2-yl)-4-methyl-5-nitrobenzenesulfonamide IUPAC Name: 3-chloro-N-(1-hydroxybutan-2-yl)-4-methyl-5-nitrobenzenesulfonamide Traditional Name: 3-chloro-4-methyl-N-(1-methylolpropyl)-5-nitro-benzenesulfonamide Formula: C11H15ClN2O5S MolecularWeight: 322.7652

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NS(=O)(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])C)Cl

Isomeric SMILES

CCC(CO)NS(=O)(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])C)Cl

InChI

InChI=1S/C11H15ClN2O5S/c1-3-8(6-15)13-20(18,19)9-4-10(12)7(2)11(5-9)14(16)17/h4-5,8,13,15H,3,6H2,1-2H3