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ethyl 4-butoxy-6-fluoranyl-2-(2-methylpropyl)-1-oxidanylidene-isoquinoline-3-carboxylate

ethyl 4-butoxy-6-fluoranyl-2-(2-methylpropyl)-1-oxidanylidene-isoquinoline-3-carboxylate

Systemtic Name:ethyl 4-butoxy-6-fluoranyl-2-(2-methylpropyl)-1-oxidanylidene-isoquinoline-3-carboxylate
Openeye Name:ethyl 4-butoxy-6-fluoro-2-isobutyl-1-oxo-isoquinoline-3-carboxylate
CAS Name:4-butoxy-6-fluoro-2-(2-methylpropyl)-1-oxo-3-isoquinolinecarboxylic acid ethyl ester
IUPAC Name:ethyl 4-butoxy-6-fluoro-2-(2-methylpropyl)-1-oxoisoquinoline-3-carboxylate
Traditional Name:4-butoxy-6-fluoro-2-isobutyl-1-keto-isoquinoline-3-carboxylic acid ethyl ester
Formula: C20H26FNO4
MolecularWeight: 363.423143
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(N(C(=O)C2=C1C=C(C=C2)F)CC(C)C)C(=O)OCC


Isomeric SMILES

CCCCOC1=C(N(C(=O)C2=C1C=C(C=C2)F)CC(C)C)C(=O)OCC


InChI

InChI=1S/C20H26FNO4/c1-5-7-10-26-18-16-11-14(21)8-9-15(16)19(23)22(12-13(3)4)17(18)20(24)25-6-2/h8-9,11,13H,5-7,10,12H2,1-4H3


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