1-(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)piperidine-4-carboxylate

Systemtic Name: 1-(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)piperidine-4-carboxylate Openeye Name: 1-(2-chloro-6,7-dimethoxy-quinazolin-4-yl)piperidine-4-carboxylate CAS Name: 1-(2-chloro-6,7-dimethoxy-4-quinazolinyl)-4-piperidinecarboxylate IUPAC Name: 1-(2-chloro-6,7-dimethoxyquinazolin-4-yl)piperidine-4-carboxylate Traditional Name: 1-(2-chloro-6,7-dimethoxy-quinazolin-4-yl)isonipecotate Formula: C16H17ClN3O4- MolecularWeight: 350.77688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)N3CCC(CC3)C(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)N3CCC(CC3)C(=O)[O-])OC

InChI

InChI=1S/C16H18ClN3O4/c1-23-12-7-10-11(8-13(12)24-2)18-16(17)19-14(10)20-5-3-9(4-6-20)15(21)22/h7-9H,3-6H2,1-2H3,(H,21,22)/p-1