3,4-dimethyl-5-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoic acid

Systemtic Name: 3,4-dimethyl-5-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoic acid Openeye Name: 3,4-dimethyl-5-[(2S)-2-methylindolin-1-yl]sulfonyl-benzoic acid CAS Name: 3,4-dimethyl-5-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoic acid IUPAC Name: 3,4-dimethyl-5-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoic acid Traditional Name: 3,4-dimethyl-5-[(2S)-2-methylindolin-1-yl]sulfonyl-benzoic acid Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1S(=O)(=O)C3=CC(=CC(=C3C)C)C(=O)O

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1S(=O)(=O)C3=CC(=CC(=C3C)C)C(=O)O

InChI

InChI=1S/C18H19NO4S/c1-11-8-15(18(20)21)10-17(13(11)3)24(22,23)19-12(2)9-14-6-4-5-7-16(14)19/h4-8,10,12H,9H2,1-3H3,(H,20,21)/t12-/m0/s1