(6-chloranyl-1-methyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)-(diethoxyphosphorylmethyl)-methyl-sulfanium

Systemtic Name: (6-chloranyl-1-methyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)-(diethoxyphosphorylmethyl)-methyl-sulfanium Openeye Name: (6-chloro-2-hydroxy-1-methyl-4-oxo-3-quinolyl)-(diethoxyphosphorylmethyl)-methyl-sulfonium CAS Name: (6-chloro-2-hydroxy-1-methyl-4-oxo-3-quinolinyl)-(diethoxyphosphorylmethyl)-methylsulfonium IUPAC Name: (6-chloro-2-hydroxy-1-methyl-4-oxoquinolin-3-yl)-(diethoxyphosphorylmethyl)-methylsulfanium Traditional Name: (6-chloro-2-hydroxy-4-keto-1-methyl-3-quinolyl)-(diethoxyphosphorylmethyl)-methyl-sulfonium Formula: C16H22ClNO5PS+ MolecularWeight: 406.841341

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C[S+](C)C1=C(N(C2=C(C1=O)C=C(C=C2)Cl)C)O)OCC

Isomeric SMILES

CCOP(=O)(C[S+](C)C1=C(N(C2=C(C1=O)C=C(C=C2)Cl)C)O)OCC

InChI

InChI=1S/C16H21ClNO5PS/c1-5-22-24(21,23-6-2)10-25(4)15-14(19)12-9-11(17)7-8-13(12)18(3)16(15)20/h7-9H,5-6,10H2,1-4H3/p+1