1-(1-oxidanylbutan-2-yl)-2-phenyl-indole-3-sulfonic acid

Systemtic Name: 1-(1-oxidanylbutan-2-yl)-2-phenyl-indole-3-sulfonic acid Openeye Name: 1-[1-(hydroxymethyl)propyl]-2-phenyl-indole-3-sulfonic acid CAS Name: 1-(1-hydroxybutan-2-yl)-2-phenyl-3-indolesulfonic acid IUPAC Name: 1-(1-hydroxybutan-2-yl)-2-phenylindole-3-sulfonic acid Traditional Name: 1-(1-methylolpropyl)-2-phenyl-indole-3-sulfonic acid Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)N1C2=CC=CC=C2C(=C1C3=CC=CC=C3)S(=O)(=O)O

Isomeric SMILES

CCC(CO)N1C2=CC=CC=C2C(=C1C3=CC=CC=C3)S(=O)(=O)O

InChI

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