6-fluoranyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-3-methyl-quinoline-4-carboxylate

Systemtic Name: 6-fluoranyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-3-methyl-quinoline-4-carboxylate Openeye Name: 6-fluoro-2-[4-(2-methoxyphenyl)piperazin-1-yl]-3-methyl-quinoline-4-carboxylate CAS Name: 6-fluoro-2-[4-(2-methoxyphenyl)-1-piperazinyl]-3-methyl-4-quinolinecarboxylate IUPAC Name: 6-fluoro-2-[4-(2-methoxyphenyl)piperazin-1-yl]-3-methylquinoline-4-carboxylate Traditional Name: 6-fluoro-2-[4-(2-methoxyphenyl)piperazino]-3-methyl-cinchoninate Formula: C22H21FN3O3- MolecularWeight: 394.418843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1C(=O)[O-])F)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1C(=O)[O-])F)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C22H22FN3O3/c1-14-20(22(27)28)16-13-15(23)7-8-17(16)24-21(14)26-11-9-25(10-12-26)18-5-3-4-6-19(18)29-2/h3-8,13H,9-12H2,1-2H3,(H,27,28)/p-1