dimethyl 5-[(3-chloranyl-4-fluoranyl-phenyl)carbamoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(3-chloranyl-4-fluoranyl-phenyl)carbamoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[(3-chloro-4-fluoroanilino)-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(3-chloro-4-fluorophenyl)carbamoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C17H14ClFN2O5 MolecularWeight: 380.754863

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)NC2=CC(=C(C=C2)F)Cl)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)NC2=CC(=C(C=C2)F)Cl)C(=O)OC

InChI

InChI=1S/C17H14ClFN2O5/c1-25-15(22)9-5-10(16(23)26-2)7-12(6-9)21-17(24)20-11-3-4-14(19)13(18)8-11/h3-8H,1-2H3,(H2,20,21,24)