methyl 7-(3-azanylazepan-1-yl)-8-chloranyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: methyl 7-(3-azanylazepan-1-yl)-8-chloranyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: methyl 7-(3-aminoazepan-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylate CAS Name: 7-(3-amino-1-azepanyl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 7-(3-aminoazepan-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylate Traditional Name: 7-(3-aminoazepan-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid methyl ester Formula: C20H23ClFN3O3 MolecularWeight: 407.866323

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)N3CCCCC(C3)N)Cl)C4CC4

Isomeric SMILES

COC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)N3CCCCC(C3)N)Cl)C4CC4

InChI

InChI=1S/C20H23ClFN3O3/c1-28-20(27)14-10-25(12-5-6-12)17-13(19(14)26)8-15(22)18(16(17)21)24-7-3-2-4-11(23)9-24/h8,10-12H,2-7,9,23H2,1H3