2-[5-[1-(phenylsulfonyl)indol-2-yl]carbonyl-3,4-dihydro-2H-pyridin-1-yl]ethanoic acid

Systemtic Name: 2-[5-[1-(phenylsulfonyl)indol-2-yl]carbonyl-3,4-dihydro-2H-pyridin-1-yl]ethanoic acid Openeye Name: 2-[5-[1-(benzenesulfonyl)indole-2-carbonyl]-3,4-dihydro-2H-pyridin-1-yl]acetic acid CAS Name: 2-[5-[[1-(benzenesulfonyl)-2-indolyl]-oxomethyl]-3,4-dihydro-2H-pyridin-1-yl]acetic acid IUPAC Name: 2-[5-[1-(benzenesulfonyl)indole-2-carbonyl]-3,4-dihydro-2H-pyridin-1-yl]acetic acid Traditional Name: 2-[5-(1-besylindole-2-carbonyl)-3,4-dihydro-2H-pyridin-1-yl]acetic acid Formula: C22H20N2O5S MolecularWeight: 424.4696

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CN(C1)CC(=O)O)C(=O)C2=CC3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC(=CN(C1)CC(=O)O)C(=O)C2=CC3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20N2O5S/c25-21(26)15-23-12-6-8-17(14-23)22(27)20-13-16-7-4-5-11-19(16)24(20)30(28,29)18-9-2-1-3-10-18/h1-5,7,9-11,13-14H,6,8,12,15H2,(H,25,26)