1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-piperazin-2-yl-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-piperazin-2-yl-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-4-oxo-7-piperazin-2-yl-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-4-oxo-7-(2-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-4-oxo-7-piperazin-2-ylquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-piperazin-2-yl-quinoline-3-carboxylic acid Formula: C17H18FN3O3 MolecularWeight: 331.341523

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)C4CNCCN4)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)C4CNCCN4)F)C(=O)O

InChI

InChI=1S/C17H18FN3O3/c18-13-5-11-15(6-10(13)14-7-19-3-4-20-14)21(9-1-2-9)8-12(16(11)22)17(23)24/h5-6,8-9,14,19-20H,1-4,7H2,(H,23,24)