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

Systemtic Name: 1-(2-methyl-2-oxidanyl-propyl)-2-phenyl-indole-3-sulfonic acid Openeye Name: 1-(2-hydroxy-2-methyl-propyl)-2-phenyl-indole-3-sulfonic acid CAS Name: 1-(2-hydroxy-2-methylpropyl)-2-phenyl-3-indolesulfonic acid IUPAC Name: 1-(2-hydroxy-2-methylpropyl)-2-phenylindole-3-sulfonic acid Traditional Name: 1-(2-hydroxy-2-methyl-propyl)-2-phenyl-indole-3-sulfonic acid Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)S(=O)(=O)O)O

Isomeric SMILES

CC(C)(CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)S(=O)(=O)O)O

InChI

InChI=1S/C18H19NO4S/c1-18(2,20)12-19-15-11-7-6-10-14(15)17(24(21,22)23)16(19)13-8-4-3-5-9-13/h3-11,20H,12H2,1-2H3,(H,21,22,23)