2-(3-methylindol-1-yl)sulfonylbenzoic acid

Systemtic Name: 2-(3-methylindol-1-yl)sulfonylbenzoic acid Openeye Name: 2-(3-methylindol-1-yl)sulfonylbenzoic acid CAS Name: 2-[(3-methyl-1-indolyl)sulfonyl]benzoic acid IUPAC Name: 2-(3-methylindol-1-yl)sulfonylbenzoic acid Traditional Name: 2-(3-methylindol-1-yl)sulfonylbenzoic acid Formula: C16H13NO4S MolecularWeight: 315.34372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=CC=CC=C12)S(=O)(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=CN(C2=CC=CC=C12)S(=O)(=O)C3=CC=CC=C3C(=O)O

InChI

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