2-[2-[[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxidanylidene-ethyl]carbamoyl]-6-fluoranyl-7-methyl-quinolin-4-yl]oxyethanoic acid

Systemtic Name: 2-[2-[[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxidanylidene-ethyl]carbamoyl]-6-fluoranyl-7-methyl-quinolin-4-yl]oxyethanoic acid Openeye Name: 2-[[2-[[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxo-ethyl]carbamoyl]-6-fluoro-7-methyl-4-quinolyl]oxy]acetic acid CAS Name: 2-[[2-[[[2-(4-ethoxycarbonyl-1-piperazinyl)-2-oxoethyl]amino]-oxomethyl]-6-fluoro-7-methyl-4-quinolinyl]oxy]acetic acid IUPAC Name: 2-[2-[[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxoethyl]carbamoyl]-6-fluoro-7-methylquinolin-4-yl]oxyacetic acid Traditional Name: 2-[[2-[[2-(4-carbethoxypiperazino)-2-keto-ethyl]carbamoyl]-6-fluoro-7-methyl-4-quinolyl]oxy]acetic acid Formula: C22H25FN4O7 MolecularWeight: 476.454903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CNC(=O)C2=NC3=CC(=C(C=C3C(=C2)OCC(=O)O)F)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CNC(=O)C2=NC3=CC(=C(C=C3C(=C2)OCC(=O)O)F)C

InChI

InChI=1S/C22H25FN4O7/c1-3-33-22(32)27-6-4-26(5-7-27)19(28)11-24-21(31)17-10-18(34-12-20(29)30)14-9-15(23)13(2)8-16(14)25-17/h8-10H,3-7,11-12H2,1-2H3,(H,24,31)(H,29,30)