3-bromanyl-5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoic acid

Systemtic Name: 3-bromanyl-5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoic acid Openeye Name: 3-bromo-5-(2-methylindolin-1-yl)sulfonyl-benzoic acid CAS Name: 3-bromo-5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoic acid IUPAC Name: 3-bromo-5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoic acid Traditional Name: 3-bromo-5-(2-methylindolin-1-yl)sulfonyl-benzoic acid Formula: C16H14BrNO4S MolecularWeight: 396.25566

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1S(=O)(=O)C3=CC(=CC(=C3)C(=O)O)Br

Isomeric SMILES

CC1CC2=CC=CC=C2N1S(=O)(=O)C3=CC(=CC(=C3)C(=O)O)Br

InChI

InChI=1S/C16H14BrNO4S/c1-10-6-11-4-2-3-5-15(11)18(10)23(21,22)14-8-12(16(19)20)7-13(17)9-14/h2-5,7-10H,6H2,1H3,(H,19,20)