1,2,5-trimethyl-3H-indole-2-sulfonic acid

Systemtic Name: 1,2,5-trimethyl-3H-indole-2-sulfonic acid Openeye Name: 1,2,5-trimethylindoline-2-sulfonic acid CAS Name: 1,2,5-trimethyl-3H-indole-2-sulfonic acid IUPAC Name: 1,2,5-trimethyl-3H-indole-2-sulfonic acid Traditional Name: 1,2,5-trimethylindoline-2-sulfonic acid Formula: C11H15NO3S MolecularWeight: 241.3067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(C2)(C)S(=O)(=O)O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(C2)(C)S(=O)(=O)O)C

InChI

InChI=1S/C11H15NO3S/c1-8-4-5-10-9(6-8)7-11(2,12(10)3)16(13,14)15/h4-6H,7H2,1-3H3,(H,13,14,15)