2-methyl-1-(2-methyl-2-oxidanyl-propyl)indole-3-sulfonic acid

Systemtic Name: 2-methyl-1-(2-methyl-2-oxidanyl-propyl)indole-3-sulfonic acid Openeye Name: 1-(2-hydroxy-2-methyl-propyl)-2-methyl-indole-3-sulfonic acid CAS Name: 1-(2-hydroxy-2-methylpropyl)-2-methyl-3-indolesulfonic acid IUPAC Name: 1-(2-hydroxy-2-methylpropyl)-2-methylindole-3-sulfonic acid Traditional Name: 1-(2-hydroxy-2-methyl-propyl)-2-methyl-indole-3-sulfonic acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CC(C)(C)O)S(=O)(=O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC(C)(C)O)S(=O)(=O)O

InChI

InChI=1S/C13H17NO4S/c1-9-12(19(16,17)18)10-6-4-5-7-11(10)14(9)8-13(2,3)15/h4-7,15H,8H2,1-3H3,(H,16,17,18)