6-fluoranyl-7-(2-hydroxyethyl)-4-oxidanylidene-2-piperazin-1-yl-1-prop-2-enyl-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-7-(2-hydroxyethyl)-4-oxidanylidene-2-piperazin-1-yl-1-prop-2-enyl-quinoline-3-carboxylic acid Openeye Name: 1-allyl-6-fluoro-7-(2-hydroxyethyl)-4-oxo-2-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 6-fluoro-7-(2-hydroxyethyl)-4-oxo-2-(1-piperazinyl)-1-prop-2-enyl-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-7-(2-hydroxyethyl)-4-oxo-2-piperazin-1-yl-1-prop-2-enylquinoline-3-carboxylic acid Traditional Name: 1-allyl-6-fluoro-7-(2-hydroxyethyl)-4-keto-2-piperazino-quinoline-3-carboxylic acid Formula: C19H22FN3O4 MolecularWeight: 375.394083

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC(=C(C=C2C(=O)C(=C1N3CCNCC3)C(=O)O)F)CCO

Isomeric SMILES

C=CCN1C2=CC(=C(C=C2C(=O)C(=C1N3CCNCC3)C(=O)O)F)CCO

InChI

InChI=1S/C19H22FN3O4/c1-2-6-23-15-10-12(3-9-24)14(20)11-13(15)17(25)16(19(26)27)18(23)22-7-4-21-5-8-22/h2,10-11,21,24H,1,3-9H2,(H,26,27)