1-ethyl-6,8-bis(fluoranyl)-4-oxidanylidene-7-(4-prop-2-enylpiperazin-1-yl)quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6,8-bis(fluoranyl)-4-oxidanylidene-7-(4-prop-2-enylpiperazin-1-yl)quinoline-3-carboxylic acid Openeye Name: 7-(4-allylpiperazin-1-yl)-1-ethyl-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6,8-difluoro-4-oxo-7-(4-prop-2-enyl-1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6,8-difluoro-4-oxo-7-(4-prop-2-enylpiperazin-1-yl)quinoline-3-carboxylic acid Traditional Name: 7-(4-allylpiperazino)-1-ethyl-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C19H21F2N3O3 MolecularWeight: 377.385146

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCN(CC3)CC=C)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCN(CC3)CC=C)F)C(=O)O

InChI

InChI=1S/C19H21F2N3O3/c1-3-5-22-6-8-24(9-7-22)17-14(20)10-12-16(15(17)21)23(4-2)11-13(18(12)25)19(26)27/h3,10-11H,1,4-9H2,2H3,(H,26,27)