1-(4-methylphenyl)sulfonylindole-5-carboxylic acid

Systemtic Name: 1-(4-methylphenyl)sulfonylindole-5-carboxylic acid Openeye Name: 1-(p-tolylsulfonyl)indole-5-carboxylic acid CAS Name: 1-(4-methylphenyl)sulfonyl-5-indolecarboxylic acid IUPAC Name: 1-(4-methylphenyl)sulfonylindole-5-carboxylic acid Traditional Name: 1-tosylindole-5-carboxylic acid Formula: C16H13NO4S MolecularWeight: 315.34372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC(=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC(=C3)C(=O)O

InChI

InChI=1S/C16H13NO4S/c1-11-2-5-14(6-3-11)22(20,21)17-9-8-12-10-13(16(18)19)4-7-15(12)17/h2-10H,1H3,(H,18,19)