3-methoxycarbonyl-1-(phenylsulfonyl)indole-2-carboxylic acid

Systemtic Name: 3-methoxycarbonyl-1-(phenylsulfonyl)indole-2-carboxylic acid Openeye Name: 1-(benzenesulfonyl)-3-methoxycarbonyl-indole-2-carboxylic acid CAS Name: 1-(benzenesulfonyl)-3-methoxycarbonyl-2-indolecarboxylic acid IUPAC Name: 1-(benzenesulfonyl)-3-methoxycarbonylindole-2-carboxylic acid Traditional Name: 1-besyl-3-carbomethoxy-indole-2-carboxylic acid Formula: C17H13NO6S MolecularWeight: 359.35322

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

COC(=O)C1=C(N(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C17H13NO6S/c1-24-17(21)14-12-9-5-6-10-13(12)18(15(14)16(19)20)25(22,23)11-7-3-2-4-8-11/h2-10H,1H3,(H,19,20)