1-ethyl-6-fluoranyl-7-[4-[(2E)-2-hydroxyimino-2-(2-oxidanylidenechromen-3-yl)ethyl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-7-[4-[(2E)-2-hydroxyimino-2-(2-oxidanylidenechromen-3-yl)ethyl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-7-[4-[(2E)-2-hydroxyimino-2-(2-oxochromen-3-yl)ethyl]piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-7-[4-[(2E)-2-hydroxyimino-2-(2-oxo-1-benzopyran-3-yl)ethyl]-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-7-[4-[(2E)-2-hydroxyimino-2-(2-oxochromen-3-yl)ethyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-7-[4-[(2E)-2-hydroximino-2-(2-ketochromen-3-yl)ethyl]piperazino]-4-keto-quinoline-3-carboxylic acid Formula: C27H25FN4O6 MolecularWeight: 520.509003

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)CC(=NO)C4=CC5=CC=CC=C5OC4=O)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C/C(=N/O)/C4=CC5=CC=CC=C5OC4=O)F)C(=O)O

InChI

InChI=1S/C27H25FN4O6/c1-2-31-14-19(26(34)35)25(33)18-12-20(28)23(13-22(18)31)32-9-7-30(8-10-32)15-21(29-37)17-11-16-5-3-4-6-24(16)38-27(17)36/h3-6,11-14,37H,2,7-10,15H2,1H3,(H,34,35)/b29-21-