2-[6-[3-[[[2-[3-(methylsulfonylamino)-4-oxidanyl-phenyl]-2-oxidanyl-ethyl]amino]methyl]phenyl]-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]ethanoate

Systemtic Name: 2-[6-[3-[[[2-[3-(methylsulfonylamino)-4-oxidanyl-phenyl]-2-oxidanyl-ethyl]amino]methyl]phenyl]-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]ethanoate Openeye Name: 2-[6-[3-[[[2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]methyl]phenyl]-2-oxo-3,4-dihydro-1H-quinolin-3-yl]acetate CAS Name: 2-[6-[3-[[[2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]methyl]phenyl]-2-oxo-3,4-dihydro-1H-quinolin-3-yl]acetate IUPAC Name: 2-[6-[3-[[[2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]methyl]phenyl]-2-oxo-3,4-dihydro-1H-quinolin-3-yl]acetate Traditional Name: 2-[6-[3-[[[2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]methyl]phenyl]-2-keto-3,4-dihydro-1H-quinolin-3-yl]acetate Formula: C27H28N3O7S- MolecularWeight: 538.59212

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C(C=CC(=C1)C(CNCC2=CC=CC(=C2)C3=CC4=C(C=C3)NC(=O)C(C4)CC(=O)[O-])O)O

Isomeric SMILES

CS(=O)(=O)NC1=C(C=CC(=C1)C(CNCC2=CC=CC(=C2)C3=CC4=C(C=C3)NC(=O)C(C4)CC(=O)[O-])O)O

InChI

InChI=1S/C27H29N3O7S/c1-38(36,37)30-23-12-19(6-8-24(23)31)25(32)15-28-14-16-3-2-4-17(9-16)18-5-7-22-20(10-18)11-21(13-26(33)34)27(35)29-22/h2-10,12,21,25,28,30-32H,11,13-15H2,1H3,(H,29,35)(H,33,34)/p-1