1-cyclopropyl-6-fluoranyl-7-[4-[(3Z)-3-hydroxyiminobutyl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[4-[(3Z)-3-hydroxyiminobutyl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[4-[(3Z)-3-hydroxyiminobutyl]piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[4-[(3Z)-3-hydroxyiminobutyl]-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[4-[(3Z)-3-hydroxyiminobutyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-7-[4-[(3Z)-3-hydroximinobutyl]piperazino]-4-keto-quinoline-3-carboxylic acid Formula: C21H25FN4O4 MolecularWeight: 416.446003

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NO)CCN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

C/C(=N/O)/CCN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C21H25FN4O4/c1-13(23-30)4-5-24-6-8-25(9-7-24)19-11-18-15(10-17(19)22)20(27)16(21(28)29)12-26(18)14-2-3-14/h10-12,14,30H,2-9H2,1H3,(H,28,29)/b23-13-