2-[[1-[2-(diphenylmethyl)sulfanylethyl]-2-oxidanylidene-3,4-dihydroquinolin-5-yl]oxy]ethanoic acid

Systemtic Name: 2-[[1-[2-(diphenylmethyl)sulfanylethyl]-2-oxidanylidene-3,4-dihydroquinolin-5-yl]oxy]ethanoic acid Openeye Name: 2-[[1-(2-benzhydrylsulfanylethyl)-2-oxo-3,4-dihydroquinolin-5-yl]oxy]acetic acid CAS Name: 2-[[1-[2-[(diphenylmethyl)thio]ethyl]-2-oxo-3,4-dihydroquinolin-5-yl]oxy]acetic acid IUPAC Name: 2-[[1-(2-benzhydrylsulfanylethyl)-2-oxo-3,4-dihydroquinolin-5-yl]oxy]acetic acid Traditional Name: 2-[[1-[2-(benzhydrylthio)ethyl]-2-keto-3,4-dihydroquinolin-5-yl]oxy]acetic acid Formula: C26H25NO4S MolecularWeight: 447.546

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C2=C1C(=CC=C2)OCC(=O)O)CCSC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC(=O)N(C2=C1C(=CC=C2)OCC(=O)O)CCSC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H25NO4S/c28-24-15-14-21-22(12-7-13-23(21)31-18-25(29)30)27(24)16-17-32-26(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-13,26H,14-18H2,(H,29,30)