tert-butyl 4-(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(2-chloro-6,7-dimethoxy-quinazolin-4-yl)piperazine-1-carboxylate CAS Name: 4-(2-chloro-6,7-dimethoxy-4-quinazolinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-chloro-6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(2-chloro-6,7-dimethoxy-quinazolin-4-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C19H25ClN4O4 MolecularWeight: 408.8792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=NC3=CC(=C(C=C32)OC)OC)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=NC3=CC(=C(C=C32)OC)OC)Cl

InChI

InChI=1S/C19H25ClN4O4/c1-19(2,3)28-18(25)24-8-6-23(7-9-24)16-12-10-14(26-4)15(27-5)11-13(12)21-17(20)22-16/h10-11H,6-9H2,1-5H3