methyl 2-chloranyl-5-[(6-chloranylpyridin-3-yl)methyl-[2-(2-methoxyethoxycarbonyl)cyclohexen-1-yl]carbonyl-amino]-4-fluoranyl-benzoate

Systemtic Name: methyl 2-chloranyl-5-[(6-chloranylpyridin-3-yl)methyl-[2-(2-methoxyethoxycarbonyl)cyclohexen-1-yl]carbonyl-amino]-4-fluoranyl-benzoate Openeye Name: methyl 2-chloro-5-[(6-chloro-3-pyridyl)methyl-[2-(2-methoxyethoxycarbonyl)cyclohexene-1-carbonyl]amino]-4-fluoro-benzoate CAS Name: 2-chloro-5-[(6-chloro-3-pyridinyl)methyl-[[2-[2-methoxyethoxy(oxo)methyl]-1-cyclohexenyl]-oxomethyl]amino]-4-fluorobenzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-[(6-chloropyridin-3-yl)methyl-[2-(2-methoxyethoxycarbonyl)cyclohexene-1-carbonyl]amino]-4-fluorobenzoate Traditional Name: 2-chloro-5-[(6-chloro-3-pyridyl)methyl-[2-(2-methoxyethoxycarbonyl)cyclohexene-1-carbonyl]amino]-4-fluoro-benzoic acid methyl ester Formula: C25H25Cl2FN2O6 MolecularWeight: 539.380203

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C1=C(CCCC1)C(=O)N(CC2=CN=C(C=C2)Cl)C3=C(C=C(C(=C3)C(=O)OC)Cl)F

Isomeric SMILES

COCCOC(=O)C1=C(CCCC1)C(=O)N(CC2=CN=C(C=C2)Cl)C3=C(C=C(C(=C3)C(=O)OC)Cl)F

InChI

InChI=1S/C25H25Cl2FN2O6/c1-34-9-10-36-25(33)17-6-4-3-5-16(17)23(31)30(14-15-7-8-22(27)29-13-15)21-11-18(24(32)35-2)19(26)12-20(21)28/h7-8,11-13H,3-6,9-10,14H2,1-2H3