tert-butyl 1-[8-chloranyl-1-cyclopropyl-3-(3-ethoxy-3-oxidanylidene-propanoyl)-6-fluoranyl-4-oxidanylidene-quinolin-7-yl]pyrrolidine-3-carboxylate

Systemtic Name: tert-butyl 1-[8-chloranyl-1-cyclopropyl-3-(3-ethoxy-3-oxidanylidene-propanoyl)-6-fluoranyl-4-oxidanylidene-quinolin-7-yl]pyrrolidine-3-carboxylate Openeye Name: tert-butyl 1-[8-chloro-1-cyclopropyl-3-(3-ethoxy-3-oxo-propanoyl)-6-fluoro-4-oxo-7-quinolyl]pyrrolidine-3-carboxylate CAS Name: 1-[8-chloro-1-cyclopropyl-3-(3-ethoxy-1,3-dioxopropyl)-6-fluoro-4-oxo-7-quinolinyl]-3-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[8-chloro-1-cyclopropyl-3-(3-ethoxy-3-oxopropanoyl)-6-fluoro-4-oxoquinolin-7-yl]pyrrolidine-3-carboxylate Traditional Name: 1-[8-chloro-1-cyclopropyl-3-(3-ethoxy-3-keto-propanoyl)-6-fluoro-4-keto-7-quinolyl]pyrrolidine-3-carboxylic acid tert-butyl ester Formula: C26H30ClFN2O6 MolecularWeight: 520.977603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)N3CCC(C3)C(=O)OC(C)(C)C)Cl)C4CC4

Isomeric SMILES

CCOC(=O)CC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)N3CCC(C3)C(=O)OC(C)(C)C)Cl)C4CC4

InChI

InChI=1S/C26H30ClFN2O6/c1-5-35-20(32)11-19(31)17-13-30(15-6-7-15)22-16(24(17)33)10-18(28)23(21(22)27)29-9-8-14(12-29)25(34)36-26(2,3)4/h10,13-15H,5-9,11-12H2,1-4H3