1-cyclopropyl-7-[(3S)-3,4-dimethylpiperazin-4-ium-1-yl]-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: 1-cyclopropyl-7-[(3S)-3,4-dimethylpiperazin-4-ium-1-yl]-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: 1-cyclopropyl-7-[(3S)-3,4-dimethylpiperazin-4-ium-1-yl]-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylate CAS Name: 1-cyclopropyl-7-[(3S)-3,4-dimethyl-1-piperazin-4-iumyl]-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylate IUPAC Name: 1-cyclopropyl-7-[(3S)-3,4-dimethylpiperazin-4-ium-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylate Traditional Name: 1-cyclopropyl-7-[(3S)-3,4-dimethylpiperazin-4-ium-1-yl]-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylate Formula: C20H24FN3O4 MolecularWeight: 389.420663

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC[NH+]1C)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)[O-])C4CC4)F

Isomeric SMILES

C[C@H]1CN(CC[NH+]1C)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)[O-])C4CC4)F

InChI

InChI=1S/C20H24FN3O4/c1-11-9-23(7-6-22(11)2)17-15(21)8-13-16(19(17)28-3)24(12-4-5-12)10-14(18(13)25)20(26)27/h8,10-12H,4-7,9H2,1-3H3,(H,26,27)/t11-/m0/s1