2-[(2,4-dichlorophenyl)carbonylamino]-5-(2,4-dimethoxypyrimidin-5-yl)benzoic acid

Systemtic Name: 2-[(2,4-dichlorophenyl)carbonylamino]-5-(2,4-dimethoxypyrimidin-5-yl)benzoic acid Openeye Name: 2-[(2,4-dichlorobenzoyl)amino]-5-(2,4-dimethoxypyrimidin-5-yl)benzoic acid CAS Name: 2-[[(2,4-dichlorophenyl)-oxomethyl]amino]-5-(2,4-dimethoxy-5-pyrimidinyl)benzoic acid IUPAC Name: 2-[(2,4-dichlorobenzoyl)amino]-5-(2,4-dimethoxypyrimidin-5-yl)benzoic acid Traditional Name: 2-[(2,4-dichlorobenzoyl)amino]-5-(2,4-dimethoxypyrimidin-5-yl)benzoic acid Formula: C20H15Cl2N3O5 MolecularWeight: 448.2562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1C2=CC(=C(C=C2)NC(=O)C3=C(C=C(C=C3)Cl)Cl)C(=O)O)OC

Isomeric SMILES

COC1=NC(=NC=C1C2=CC(=C(C=C2)NC(=O)C3=C(C=C(C=C3)Cl)Cl)C(=O)O)OC

InChI

InChI=1S/C20H15Cl2N3O5/c1-29-18-14(9-23-20(25-18)30-2)10-3-6-16(13(7-10)19(27)28)24-17(26)12-5-4-11(21)8-15(12)22/h3-9H,1-2H3,(H,24,26)(H,27,28)