1-ethyl-6,8-bis(fluoranyl)-7-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6,8-bis(fluoranyl)-7-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6,8-difluoro-7-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6,8-difluoro-7-[4-(2-hydroxyethyl)-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6,8-difluoro-7-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6,8-difluoro-7-[4-(2-hydroxyethyl)piperazino]-4-keto-quinoline-3-carboxylic acid Formula: C18H21F2N3O4 MolecularWeight: 381.373846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21F2N3O4/c1-2-22-10-12(18(26)27)17(25)11-9-13(19)16(14(20)15(11)22)23-5-3-21(4-6-23)7-8-24/h9-10,24H,2-8H2,1H3,(H,26,27)