1-ethyl-6-fluoranyl-7-[4-[(2Z)-2-methoxyimino-2-thiophen-3-yl-ethyl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-7-[4-[(2Z)-2-methoxyimino-2-thiophen-3-yl-ethyl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-7-[4-[(2Z)-2-methoxyimino-2-(3-thienyl)ethyl]piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-7-[4-[(2Z)-2-methoxyimino-2-(3-thiophenyl)ethyl]-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-7-[4-[(2Z)-2-methoxyimino-2-thiophen-3-ylethyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-4-keto-7-[4-[(2Z)-2-methyloximino-2-(3-thienyl)ethyl]piperazino]quinoline-3-carboxylic acid Formula: C23H25FN4O4S MolecularWeight: 472.532403

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)CC(=NOC)C4=CSC=C4)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C/C(=N\OC)/C4=CSC=C4)F)C(=O)O

InChI

InChI=1S/C23H25FN4O4S/c1-3-27-12-17(23(30)31)22(29)16-10-18(24)21(11-20(16)27)28-7-5-26(6-8-28)13-19(25-32-2)15-4-9-33-14-15/h4,9-12,14H,3,5-8,13H2,1-2H3,(H,30,31)/b25-19+