5-methyl-3-[(phenylmethyl)sulfonylamino]-1H-indole-2-carboxylic acid

Systemtic Name: 5-methyl-3-[(phenylmethyl)sulfonylamino]-1H-indole-2-carboxylic acid Openeye Name: 3-(benzylsulfonylamino)-5-methyl-1H-indole-2-carboxylic acid CAS Name: 5-methyl-3-[(phenylmethyl)sulfonylamino]-1H-indole-2-carboxylic acid IUPAC Name: 3-(benzylsulfonylamino)-5-methyl-1H-indole-2-carboxylic acid Traditional Name: 3-(benzylsulfonylamino)-5-methyl-1H-indole-2-carboxylic acid Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2NS(=O)(=O)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2NS(=O)(=O)CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C17H16N2O4S/c1-11-7-8-14-13(9-11)15(16(18-14)17(20)21)19-24(22,23)10-12-5-3-2-4-6-12/h2-9,18-19H,10H2,1H3,(H,20,21)