1-cyclopropyl-7-(3-fluoranylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-(3-fluoranylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-(3-fluoropiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-(3-fluoro-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-(3-fluoropiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-(3-fluoropiperazino)-4-keto-quinoline-3-carboxylic acid Formula: C17H18FN3O3 MolecularWeight: 331.341523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=C2C=C(C=C3)N4CCNC(C4)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=C2C=C(C=C3)N4CCNC(C4)F)C(=O)O

InChI

InChI=1S/C17H18FN3O3/c18-15-9-20(6-5-19-15)11-3-4-12-14(7-11)21(10-1-2-10)8-13(16(12)22)17(23)24/h3-4,7-8,10,15,19H,1-2,5-6,9H2,(H,23,24)