copper; 1-cyclopropyl-6-fluoranyl-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylate; 1,10-phenanthroline-5,6-dione; chloride

Systemtic Name: copper; 1-cyclopropyl-6-fluoranyl-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylate; 1,10-phenanthroline-5,6-dione; chloride Openeye Name: copper; 1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylate; 1,10-phenanthroline-5,6-dione; chloride CAS Name: copper; 1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylate; 1,10-phenanthroline-5,6-dione; chloride IUPAC Name: copper; 1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylate; 1,10-phenanthroline-5,6-dione; chloride Traditional Name: cupric; 1-cyclopropyl-6-fluoro-4-keto-8-methoxy-7-(3-methylpiperazino)quinoline-3-carboxylate; 1,10-phenanthroline-5,6-quinone; chloride Formula: C31H27ClCuFN5O6 MolecularWeight: 683.573383

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)[O-])C4CC4)F.C1=CC2=C(C3=C(C=CC=N3)C(=O)C2=O)N=C1.[Cl-].[Cu+2]

Isomeric SMILES

CC1CN(CCN1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)[O-])C4CC4)F.C1=CC2=C(C3=C(C=CC=N3)C(=O)C2=O)N=C1.[Cl-].[Cu+2]

InChI

InChI=1S/C19H22FN3O4.C12H6N2O2.ClH.Cu/c1-10-8-22(6-5-21-10)16-14(20)7-12-15(18(16)27-2)23(11-3-4-11)9-13(17(12)24)19(25)26;15-11-7-3-1-5-13-9(7)10-8(12(11)16)4-2-6-14-10;;/h7,9-11,21H,3-6,8H2,1-2H3,(H,25,26);1-6H;1H;/q;;;+2/p-2