2,6,6-trimethyl-4-oxidanylidene-1-phenyl-5,7-dihydroindole-3-sulfonic acid

Systemtic Name: 2,6,6-trimethyl-4-oxidanylidene-1-phenyl-5,7-dihydroindole-3-sulfonic acid Openeye Name: 2,6,6-trimethyl-4-oxo-1-phenyl-5,7-dihydroindole-3-sulfonic acid CAS Name: 2,6,6-trimethyl-4-oxo-1-phenyl-5,7-dihydroindole-3-sulfonic acid IUPAC Name: 2,6,6-trimethyl-4-oxo-1-phenyl-5,7-dihydroindole-3-sulfonic acid Traditional Name: 4-keto-2,6,6-trimethyl-1-phenyl-5,7-dihydroindole-3-sulfonic acid Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C3=CC=CC=C3)CC(CC2=O)(C)C)S(=O)(=O)O

Isomeric SMILES

CC1=C(C2=C(N1C3=CC=CC=C3)CC(CC2=O)(C)C)S(=O)(=O)O

InChI

InChI=1S/C17H19NO4S/c1-11-16(23(20,21)22)15-13(9-17(2,3)10-14(15)19)18(11)12-7-5-4-6-8-12/h4-8H,9-10H2,1-3H3,(H,20,21,22)