dimethyl 2-[(1-cyclopropyl-6-fluoranyl-3-methoxycarbonyl-8-nitro-4-oxidanylidene-quinolin-7-yl)amino]pentanedioate

Systemtic Name: dimethyl 2-[(1-cyclopropyl-6-fluoranyl-3-methoxycarbonyl-8-nitro-4-oxidanylidene-quinolin-7-yl)amino]pentanedioate Openeye Name: dimethyl 2-[(1-cyclopropyl-6-fluoro-3-methoxycarbonyl-8-nitro-4-oxo-7-quinolyl)amino]pentanedioate CAS Name: 2-[(1-cyclopropyl-6-fluoro-3-methoxycarbonyl-8-nitro-4-oxo-7-quinolinyl)amino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(1-cyclopropyl-6-fluoro-3-methoxycarbonyl-8-nitro-4-oxoquinolin-7-yl)amino]pentanedioate Traditional Name: 2-[(3-carbomethoxy-1-cyclopropyl-6-fluoro-4-keto-8-nitro-7-quinolyl)amino]glutaric acid dimethyl ester Formula: C21H22FN3O9 MolecularWeight: 479.412483

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(C(=O)OC)NC1=C(C=C2C(=C1[N+](=O)[O-])N(C=C(C2=O)C(=O)OC)C3CC3)F

Isomeric SMILES

COC(=O)CCC(C(=O)OC)NC1=C(C=C2C(=C1[N+](=O)[O-])N(C=C(C2=O)C(=O)OC)C3CC3)F

InChI

InChI=1S/C21H22FN3O9/c1-32-15(26)7-6-14(21(29)34-3)23-16-13(22)8-11-17(18(16)25(30)31)24(10-4-5-10)9-12(19(11)27)20(28)33-2/h8-10,14,23H,4-7H2,1-3H3