1-(4-tert-butylphenyl)sulfonylindole-3-carboxylic acid

Systemtic Name: 1-(4-tert-butylphenyl)sulfonylindole-3-carboxylic acid Openeye Name: 1-(4-tert-butylphenyl)sulfonylindole-3-carboxylic acid CAS Name: 1-(4-tert-butylphenyl)sulfonyl-3-indolecarboxylic acid IUPAC Name: 1-(4-tert-butylphenyl)sulfonylindole-3-carboxylic acid Traditional Name: 1-(4-tert-butylphenyl)sulfonylindole-3-carboxylic acid Formula: C19H19NO4S MolecularWeight: 357.42346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C19H19NO4S/c1-19(2,3)13-8-10-14(11-9-13)25(23,24)20-12-16(18(21)22)15-6-4-5-7-17(15)20/h4-12H,1-3H3,(H,21,22)