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

Systemtic Name: methyl 8-chloranyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[4-oxidanylidene-3-(propylamino)azepan-1-yl]quinoline-3-carboxylate Openeye Name: methyl 8-chloro-1-cyclopropyl-6-fluoro-4-oxo-7-[4-oxo-3-(propylamino)azepan-1-yl]quinoline-3-carboxylate CAS Name: 8-chloro-1-cyclopropyl-6-fluoro-4-oxo-7-[4-oxo-3-(propylamino)-1-azepanyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 8-chloro-1-cyclopropyl-6-fluoro-4-oxo-7-[4-oxo-3-(propylamino)azepan-1-yl]quinoline-3-carboxylate Traditional Name: 8-chloro-1-cyclopropyl-6-fluoro-4-keto-7-[4-keto-3-(propylamino)azepan-1-yl]quinoline-3-carboxylic acid methyl ester Formula: C23H27ClFN3O4 MolecularWeight: 463.929583

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1CN(CCCC1=O)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)OC)C4CC4)F

Isomeric SMILES

CCCNC1CN(CCCC1=O)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)OC)C4CC4)F

InChI

InChI=1S/C23H27ClFN3O4/c1-3-8-26-17-12-27(9-4-5-18(17)29)21-16(25)10-14-20(19(21)24)28(13-6-7-13)11-15(22(14)30)23(31)32-2/h10-11,13,17,26H,3-9,12H2,1-2H3