methyl 8-chloranyl-1-cyclopropyl-6-fluoranyl-7-[3-(methylamino)-4-oxidanylidene-azepan-1-yl]-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: methyl 8-chloranyl-1-cyclopropyl-6-fluoranyl-7-[3-(methylamino)-4-oxidanylidene-azepan-1-yl]-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: methyl 8-chloro-1-cyclopropyl-6-fluoro-7-[3-(methylamino)-4-oxo-azepan-1-yl]-4-oxo-quinoline-3-carboxylate CAS Name: 8-chloro-1-cyclopropyl-6-fluoro-7-[3-(methylamino)-4-oxo-1-azepanyl]-4-oxo-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 8-chloro-1-cyclopropyl-6-fluoro-7-[3-(methylamino)-4-oxoazepan-1-yl]-4-oxoquinoline-3-carboxylate Traditional Name: 8-chloro-1-cyclopropyl-6-fluoro-4-keto-7-[4-keto-3-(methylamino)azepan-1-yl]quinoline-3-carboxylic acid methyl ester Formula: C21H23ClFN3O4 MolecularWeight: 435.876423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1CN(CCCC1=O)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)OC)C4CC4)F

Isomeric SMILES

CNC1CN(CCCC1=O)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)OC)C4CC4)F

InChI

InChI=1S/C21H23ClFN3O4/c1-24-15-10-25(7-3-4-16(15)27)19-14(23)8-12-18(17(19)22)26(11-5-6-11)9-13(20(12)28)21(29)30-2/h8-9,11,15,24H,3-7,10H2,1-2H3