1-cyclopropyl-6-fluoranyl-8-(methoxymethyl)-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-8-(methoxymethyl)-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-8-(methoxymethyl)-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-8-(methoxymethyl)-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-8-(methoxymethyl)-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-8-(methoxymethyl)-7-piperazino-quinoline-3-carboxylic acid Formula: C19H22FN3O4 MolecularWeight: 375.394083

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C2C(=CC(=C1N3CCNCC3)F)C(=O)C(=CN2C4CC4)C(=O)O

Isomeric SMILES

COCC1=C2C(=CC(=C1N3CCNCC3)F)C(=O)C(=CN2C4CC4)C(=O)O

InChI

InChI=1S/C19H22FN3O4/c1-27-10-14-16-12(8-15(20)17(14)22-6-4-21-5-7-22)18(24)13(19(25)26)9-23(16)11-2-3-11/h8-9,11,21H,2-7,10H2,1H3,(H,25,26)