dimethyl 5-[(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)amino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)amino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(2-chloro-6,7-dimethoxy-quinazolin-4-yl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[(2-chloro-6,7-dimethoxy-4-quinazolinyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(2-chloro-6,7-dimethoxyquinazolin-4-yl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(2-chloro-6,7-dimethoxy-quinazolin-4-yl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H18ClN3O6 MolecularWeight: 431.82642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC)OC

InChI

InChI=1S/C20H18ClN3O6/c1-27-15-8-13-14(9-16(15)28-2)23-20(21)24-17(13)22-12-6-10(18(25)29-3)5-11(7-12)19(26)30-4/h5-9H,1-4H3,(H,22,23,24)