dimethyl 5-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(5-chloro-2,3-dihydro-1,4-benzodioxine-7-carbonyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(5-chloro-2,3-dihydro-1,4-benzodioxine-7-carbonyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-carbonyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C19H16ClNO7 MolecularWeight: 405.78584

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC3=C(C(=C2)Cl)OCCO3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC3=C(C(=C2)Cl)OCCO3)C(=O)OC

InChI

InChI=1S/C19H16ClNO7/c1-25-18(23)11-5-12(19(24)26-2)7-13(6-11)21-17(22)10-8-14(20)16-15(9-10)27-3-4-28-16/h5-9H,3-4H2,1-2H3,(H,21,22)