N-(4-fluorophenyl)-6,7-dimethoxy-2-(2-methylpropyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-(4-fluorophenyl)-6,7-dimethoxy-2-(2-methylpropyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(4-fluorophenyl)-2-isobutyl-6,7-dimethoxy-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(4-fluorophenyl)-6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(4-fluorophenyl)-6,7-dimethoxy-2-(2-methylpropyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(4-fluorophenyl)-2-isobutyl-1-keto-6,7-dimethoxy-isoquinoline-4-carboxamide Formula: C22H23FN2O4 MolecularWeight: 398.427423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)CN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C22H23FN2O4/c1-13(2)11-25-12-18(21(26)24-15-7-5-14(23)6-8-15)16-9-19(28-3)20(29-4)10-17(16)22(25)27/h5-10,12-13H,11H2,1-4H3,(H,24,26)