(1-ethylsulfanylcarbonyloxy-2-oxidanylidene-2-propan-2-yloxy-ethyl) 3,7-bis(chloranyl)quinoline-8-carboxylate

Systemtic Name: (1-ethylsulfanylcarbonyloxy-2-oxidanylidene-2-propan-2-yloxy-ethyl) 3,7-bis(chloranyl)quinoline-8-carboxylate Openeye Name: (1-ethylsulfanylcarbonyloxy-2-isopropoxy-2-oxo-ethyl) 3,7-dichloroquinoline-8-carboxylate CAS Name: 3,7-dichloro-8-quinolinecarboxylic acid [1-[(ethylthio)-oxomethoxy]-2-oxo-2-propan-2-yloxyethyl] ester IUPAC Name: (1-ethylsulfanylcarbonyloxy-2-oxo-2-propan-2-yloxyethyl) 3,7-dichloroquinoline-8-carboxylate Traditional Name: 3,7-dichloroquinoline-8-carboxylic acid [1-(ethylthio)carbonyloxy-2-isopropoxy-2-keto-ethyl] ester Formula: C18H17Cl2NO6S MolecularWeight: 446.30168

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)OC(C(=O)OC(C)C)OC(=O)C1=C(C=CC2=CC(=CN=C21)Cl)Cl

Isomeric SMILES

CCSC(=O)OC(C(=O)OC(C)C)OC(=O)C1=C(C=CC2=CC(=CN=C21)Cl)Cl

InChI

InChI=1S/C18H17Cl2NO6S/c1-4-28-18(24)27-17(16(23)25-9(2)3)26-15(22)13-12(20)6-5-10-7-11(19)8-21-14(10)13/h5-9,17H,4H2,1-3H3