2-[[2,4-bis(chloranyl)-5-methoxycarbonyl-phenyl]-pyridin-3-ylcarbonyl-carbamoyl]cyclohexene-1-carboxylic acid

Systemtic Name: 2-[[2,4-bis(chloranyl)-5-methoxycarbonyl-phenyl]-pyridin-3-ylcarbonyl-carbamoyl]cyclohexene-1-carboxylic acid Openeye Name: 2-[(2,4-dichloro-5-methoxycarbonyl-phenyl)-(pyridine-3-carbonyl)carbamoyl]cyclohexene-1-carboxylic acid CAS Name: 2-[(2,4-dichloro-5-methoxycarbonyl-N-[oxo(3-pyridinyl)methyl]anilino)-oxomethyl]-1-cyclohexenecarboxylic acid IUPAC Name: 2-[(2,4-dichloro-5-methoxycarbonylphenyl)-(pyridine-3-carbonyl)carbamoyl]cyclohexene-1-carboxylic acid Traditional Name: 2-[(5-carbomethoxy-2,4-dichloro-phenyl)-nicotinoyl-carbamoyl]cyclohexene-1-carboxylic acid Formula: C22H18Cl2N2O6 MolecularWeight: 477.29412

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1Cl)Cl)N(C(=O)C2=C(CCCC2)C(=O)O)C(=O)C3=CN=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1Cl)Cl)N(C(=O)C2=C(CCCC2)C(=O)O)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C22H18Cl2N2O6/c1-32-22(31)15-9-18(17(24)10-16(15)23)26(19(27)12-5-4-8-25-11-12)20(28)13-6-2-3-7-14(13)21(29)30/h4-5,8-11H,2-3,6-7H2,1H3,(H,29,30)