1-ethyl-6-fluoranyl-7-[4-(N'-methylcarbamimidoyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-7-[4-(N'-methylcarbamimidoyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-7-[4-(N'-methylcarbamimidoyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-[amino(methylimino)methyl]-1-piperazinyl]-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-7-[4-(N'-methylcarbamimidoyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-4-keto-7-[4-(N'-methylamidino)piperazino]quinoline-3-carboxylic acid Formula: C18H22FN5O3 MolecularWeight: 375.397383

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22FN5O3/c1-3-22-10-12(17(26)27)16(25)11-8-13(19)15(9-14(11)22)23-4-6-24(7-5-23)18(20)21-2/h8-10H,3-7H2,1-2H3,(H2,20,21)(H,26,27)