ethyl 7-[3-(bromomethyl)-4-cyano-phenyl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 7-[3-(bromomethyl)-4-cyano-phenyl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 7-[3-(bromomethyl)-4-cyano-phenyl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylate CAS Name: 7-[3-(bromomethyl)-4-cyanophenyl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-[3-(bromomethyl)-4-cyanophenyl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylate Traditional Name: 7-[3-(bromomethyl)-4-cyano-phenyl]-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid ethyl ester Formula: C24H20BrFN2O4 MolecularWeight: 499.329003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)C3=CC(=C(C=C3)C#N)CBr)OC)C4CC4

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)C3=CC(=C(C=C3)C#N)CBr)OC)C4CC4

InChI

InChI=1S/C24H20BrFN2O4/c1-3-32-24(30)18-12-28(16-6-7-16)21-17(22(18)29)9-19(26)20(23(21)31-2)13-4-5-14(11-27)15(8-13)10-25/h4-5,8-9,12,16H,3,6-7,10H2,1-2H3