1-[(1-methylsulfonyl-2,3-dihydroindol-5-yl)carbonyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-[(1-methylsulfonyl-2,3-dihydroindol-5-yl)carbonyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-(1-methylsulfonylindoline-5-carbonyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[(1-methylsulfonyl-2,3-dihydroindol-5-yl)-oxomethyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-(1-methylsulfonyl-2,3-dihydroindole-5-carbonyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-(1-mesylindoline-5-carbonyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)N3CCCC4=C(C=CC=C43)C(=O)O

Isomeric SMILES

CS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)N3CCCC4=C(C=CC=C43)C(=O)O

InChI

InChI=1S/C20H20N2O5S/c1-28(26,27)22-11-9-13-12-14(7-8-17(13)22)19(23)21-10-3-5-15-16(20(24)25)4-2-6-18(15)21/h2,4,6-8,12H,3,5,9-11H2,1H3,(H,24,25)