ethyl 7-[4-(aminomethyl)phenyl]-1-ethyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 7-[4-(aminomethyl)phenyl]-1-ethyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 7-[4-(aminomethyl)phenyl]-1-ethyl-6,8-difluoro-4-oxo-quinoline-3-carboxylate CAS Name: 7-[4-(aminomethyl)phenyl]-1-ethyl-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-[4-(aminomethyl)phenyl]-1-ethyl-6,8-difluoro-4-oxoquinoline-3-carboxylate Traditional Name: 7-[4-(aminomethyl)phenyl]-1-ethyl-6,8-difluoro-4-keto-quinoline-3-carboxylic acid ethyl ester Formula: C21H20F2N2O3 MolecularWeight: 386.391906

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)C3=CC=C(C=C3)CN)F)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)C3=CC=C(C=C3)CN)F)C(=O)OCC

InChI

InChI=1S/C21H20F2N2O3/c1-3-25-11-15(21(27)28-4-2)20(26)14-9-16(22)17(18(23)19(14)25)13-7-5-12(10-24)6-8-13/h5-9,11H,3-4,10,24H2,1-2H3