N-[[4-(2-methyl-1-oxidanyl-propan-2-yl)phenyl]methyl]pyridine-3-sulfonamide; sulfuric acid

Systemtic Name: N-[[4-(2-methyl-1-oxidanyl-propan-2-yl)phenyl]methyl]pyridine-3-sulfonamide; sulfuric acid Openeye Name: N-[[4-(2-hydroxy-1,1-dimethyl-ethyl)phenyl]methyl]pyridine-3-sulfonamide; sulfuric acid CAS Name: N-[[4-(1-hydroxy-2-methylpropan-2-yl)phenyl]methyl]-3-pyridinesulfonamide; sulfuric acid IUPAC Name: N-[[4-(1-hydroxy-2-methylpropan-2-yl)phenyl]methyl]pyridine-3-sulfonamide; sulfuric acid Traditional Name: N-[4-(2-hydroxy-1,1-dimethyl-ethyl)benzyl]pyridine-3-sulfonamide; sulfuric acid Formula: C16H22N2O7S2 MolecularWeight: 418.48508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)C1=CC=C(C=C1)CNS(=O)(=O)C2=CN=CC=C2.OS(=O)(=O)O

Isomeric SMILES

CC(C)(CO)C1=CC=C(C=C1)CNS(=O)(=O)C2=CN=CC=C2.OS(=O)(=O)O

InChI

InChI=1S/C16H20N2O3S.H2O4S/c1-16(2,12-19)14-7-5-13(6-8-14)10-18-22(20,21)15-4-3-9-17-11-15;1-5(2,3)4/h3-9,11,18-19H,10,12H2,1-2H3;(H2,1,2,3,4)