2-(2-acetyloxyphenyl)carbonyloxyethyl-methyl-(1-methyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)sulfanium

Systemtic Name: 2-(2-acetyloxyphenyl)carbonyloxyethyl-methyl-(1-methyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)sulfanium Openeye Name: 2-(2-acetoxybenzoyl)oxyethyl-(2-hydroxy-1-methyl-4-oxo-3-quinolyl)-methyl-sulfonium CAS Name: 2-[(2-acetyloxyphenyl)-oxomethoxy]ethyl-(2-hydroxy-1-methyl-4-oxo-3-quinolinyl)-methylsulfonium IUPAC Name: 2-(2-acetyloxybenzoyl)oxyethyl-(2-hydroxy-1-methyl-4-oxoquinolin-3-yl)-methylsulfanium Traditional Name: 2-(2-acetoxybenzoyl)oxyethyl-(2-hydroxy-4-keto-1-methyl-3-quinolyl)-methyl-sulfonium Formula: C22H22NO6S+ MolecularWeight: 428.47818

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)OCC[S+](C)C2=C(N(C3=CC=CC=C3C2=O)C)O

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)OCC[S+](C)C2=C(N(C3=CC=CC=C3C2=O)C)O

InChI

InChI=1S/C22H21NO6S/c1-14(24)29-18-11-7-5-9-16(18)22(27)28-12-13-30(3)20-19(25)15-8-4-6-10-17(15)23(2)21(20)26/h4-11H,12-13H2,1-3H3/p+1