4-(2,3-dihydroindol-1-yl)-3-methylsulfonyl-benzoic acid

Systemtic Name: 4-(2,3-dihydroindol-1-yl)-3-methylsulfonyl-benzoic acid Openeye Name: 4-indolin-1-yl-3-methylsulfonyl-benzoic acid CAS Name: 4-(2,3-dihydroindol-1-yl)-3-methylsulfonylbenzoic acid IUPAC Name: 4-(2,3-dihydroindol-1-yl)-3-methylsulfonylbenzoic acid Traditional Name: 4-indolin-1-yl-3-mesyl-benzoic acid Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)N2CCC3=CC=CC=C32

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)N2CCC3=CC=CC=C32

InChI

InChI=1S/C16H15NO4S/c1-22(20,21)15-10-12(16(18)19)6-7-14(15)17-9-8-11-4-2-3-5-13(11)17/h2-7,10H,8-9H2,1H3,(H,18,19)