1-(2-fluoranylcyclopropyl)-7-[3-(fluoranylmethyl)piperazin-1-yl]-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-(2-fluoranylcyclopropyl)-7-[3-(fluoranylmethyl)piperazin-1-yl]-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(2-fluorocyclopropyl)-7-[3-(fluoromethyl)piperazin-1-yl]-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(2-fluorocyclopropyl)-7-[3-(fluoromethyl)-1-piperazinyl]-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(2-fluorocyclopropyl)-7-[3-(fluoromethyl)piperazin-1-yl]-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(2-fluorocyclopropyl)-7-[3-(fluoromethyl)piperazino]-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C19H21F2N3O4 MolecularWeight: 393.384546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3F)N4CCNC(C4)CF

Isomeric SMILES

COC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3F)N4CCNC(C4)CF

InChI

InChI=1S/C19H21F2N3O4/c1-28-18-14(23-5-4-22-10(7-20)8-23)3-2-11-16(18)24(15-6-13(15)21)9-12(17(11)25)19(26)27/h2-3,9-10,13,15,22H,4-8H2,1H3,(H,26,27)