8-chloranyl-1-cyclopropyl-7-[3-(ethylamino)azepan-1-yl]-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 8-chloranyl-1-cyclopropyl-7-[3-(ethylamino)azepan-1-yl]-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 8-chloro-1-cyclopropyl-7-[3-(ethylamino)azepan-1-yl]-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 8-chloro-1-cyclopropyl-7-[3-(ethylamino)-1-azepanyl]-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 8-chloro-1-cyclopropyl-7-[3-(ethylamino)azepan-1-yl]-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 8-chloro-1-cyclopropyl-7-[3-(ethylamino)azepan-1-yl]-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C21H25ClFN3O3 MolecularWeight: 421.892903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1CCCCN(C1)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

CCNC1CCCCN(C1)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C21H25ClFN3O3/c1-2-24-12-5-3-4-8-25(10-12)19-16(23)9-14-18(17(19)22)26(13-6-7-13)11-15(20(14)27)21(28)29/h9,11-13,24H,2-8,10H2,1H3,(H,28,29)