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ethyl 6,7-bis(chloranyl)-2-methyl-1-oxidanylidene-4-(trifluoromethylsulfonyloxy)isoquinoline-3-carboxylate

ethyl 6,7-bis(chloranyl)-2-methyl-1-oxidanylidene-4-(trifluoromethylsulfonyloxy)isoquinoline-3-carboxylate

Systemtic Name:ethyl 6,7-bis(chloranyl)-2-methyl-1-oxidanylidene-4-(trifluoromethylsulfonyloxy)isoquinoline-3-carboxylate
Openeye Name:ethyl 6,7-dichloro-2-methyl-1-oxo-4-(trifluoromethylsulfonyloxy)isoquinoline-3-carboxylate
CAS Name:6,7-dichloro-2-methyl-1-oxo-4-(trifluoromethylsulfonyloxy)-3-isoquinolinecarboxylic acid ethyl ester
IUPAC Name:ethyl 6,7-dichloro-2-methyl-1-oxo-4-(trifluoromethylsulfonyloxy)isoquinoline-3-carboxylate
Traditional Name:6,7-dichloro-1-keto-2-methyl-4-triflyloxy-isoquinoline-3-carboxylic acid ethyl ester
Formula: C14H10Cl2F3NO6S
MolecularWeight: 448.19851
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2C(=O)N1C)Cl)Cl)OS(=O)(=O)C(F)(F)F


Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2C(=O)N1C)Cl)Cl)OS(=O)(=O)C(F)(F)F


InChI

InChI=1S/C14H10Cl2F3NO6S/c1-3-25-13(22)10-11(26-27(23,24)14(17,18)19)6-4-8(15)9(16)5-7(6)12(21)20(10)2/h4-5H,3H2,1-2H3


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