N-[2-(3,4-dimethoxyphenyl)ethyl]-6-fluoranyl-1-methyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-fluoranyl-1-methyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-fluoro-1-methyl-4-oxo-quinoline-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-fluoro-1-methyl-4-oxo-3-quinolinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-fluoro-1-methyl-4-oxoquinoline-3-carboxamide Traditional Name: 6-fluoro-N-homoveratryl-4-keto-1-methyl-quinoline-3-carboxamide Formula: C21H21FN2O4 MolecularWeight: 384.400843

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1C=CC(=C2)F)C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN1C=C(C(=O)C2=C1C=CC(=C2)F)C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H21FN2O4/c1-24-12-16(20(25)15-11-14(22)5-6-17(15)24)21(26)23-9-8-13-4-7-18(27-2)19(10-13)28-3/h4-7,10-12H,8-9H2,1-3H3,(H,23,26)