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

Systemtic Name: 1-cyclopropyl-6,8-bis(fluoranyl)-7-[4-(2-hydroxyethyl)-3-methyl-piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6,8-difluoro-7-[4-(2-hydroxyethyl)-3-methyl-piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6,8-difluoro-7-[4-(2-hydroxyethyl)-3-methyl-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6,8-difluoro-7-[4-(2-hydroxyethyl)-3-methylpiperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6,8-difluoro-7-[4-(2-hydroxyethyl)-3-methyl-piperazino]-4-keto-quinoline-3-carboxylic acid Formula: C20H23F2N3O4 MolecularWeight: 407.411126

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CCO)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

CC1CN(CCN1CCO)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C20H23F2N3O4/c1-11-9-24(5-4-23(11)6-7-26)18-15(21)8-13-17(16(18)22)25(12-2-3-12)10-14(19(13)27)20(28)29/h8,10-12,26H,2-7,9H2,1H3,(H,28,29)