[2-methyl-4-(1-oxidanylpentan-3-yl)phenyl]sulfamic acid

Systemtic Name: [2-methyl-4-(1-oxidanylpentan-3-yl)phenyl]sulfamic acid Openeye Name: [4-(1-ethyl-3-hydroxy-propyl)-2-methyl-phenyl]sulfamic acid CAS Name: [4-(1-hydroxypentan-3-yl)-2-methylphenyl]sulfamic acid IUPAC Name: [4-(1-hydroxypentan-3-yl)-2-methylphenyl]sulfamic acid Traditional Name: [4-(1-ethyl-3-hydroxy-propyl)-2-methyl-phenyl]sulfamic acid Formula: C12H19NO4S MolecularWeight: 273.34856

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCO)C1=CC(=C(C=C1)NS(=O)(=O)O)C

Isomeric SMILES

CCC(CCO)C1=CC(=C(C=C1)NS(=O)(=O)O)C

InChI

InChI=1S/C12H19NO4S/c1-3-10(6-7-14)11-4-5-12(9(2)8-11)13-18(15,16)17/h4-5,8,10,13-14H,3,6-7H2,1-2H3,(H,15,16,17)