dimethyl 6-chloranylisoquinoline-1,3-dicarboxylate

Systemtic Name: dimethyl 6-chloranylisoquinoline-1,3-dicarboxylate Openeye Name: dimethyl 6-chloroisoquinoline-1,3-dicarboxylate CAS Name: 6-chloroisoquinoline-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 6-chloroisoquinoline-1,3-dicarboxylate Traditional Name: 6-chloroisoquinoline-1,3-dicarboxylic acid dimethyl ester Formula: C13H10ClNO4 MolecularWeight: 279.6758

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC(=C2C=CC(=CC2=C1)Cl)C(=O)OC

Isomeric SMILES

COC(=O)C1=NC(=C2C=CC(=CC2=C1)Cl)C(=O)OC

InChI

InChI=1S/C13H10ClNO4/c1-18-12(16)10-6-7-5-8(14)3-4-9(7)11(15-10)13(17)19-2/h3-6H,1-2H3