(2-methyl-2-oxidanyl-propyl) 4-(4-azanyl-6-chloranyl-7,8-dimethoxy-quinazolin-2-yl)piperazine-1-carboxylate

Systemtic Name: (2-methyl-2-oxidanyl-propyl) 4-(4-azanyl-6-chloranyl-7,8-dimethoxy-quinazolin-2-yl)piperazine-1-carboxylate Openeye Name: (2-hydroxy-2-methyl-propyl) 4-(4-amino-6-chloro-7,8-dimethoxy-quinazolin-2-yl)piperazine-1-carboxylate CAS Name: 4-(4-amino-6-chloro-7,8-dimethoxy-2-quinazolinyl)-1-piperazinecarboxylic acid (2-hydroxy-2-methylpropyl) ester IUPAC Name: (2-hydroxy-2-methylpropyl) 4-(4-amino-6-chloro-7,8-dimethoxyquinazolin-2-yl)piperazine-1-carboxylate Traditional Name: 4-(4-amino-6-chloro-7,8-dimethoxy-quinazolin-2-yl)piperazine-1-carboxylic acid (2-hydroxy-2-methyl-propyl) ester Formula: C19H26ClN5O5 MolecularWeight: 439.89324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC(=O)N1CCN(CC1)C2=NC3=C(C(=C(C=C3C(=N2)N)Cl)OC)OC)O

Isomeric SMILES

CC(C)(COC(=O)N1CCN(CC1)C2=NC3=C(C(=C(C=C3C(=N2)N)Cl)OC)OC)O

InChI

InChI=1S/C19H26ClN5O5/c1-19(2,27)10-30-18(26)25-7-5-24(6-8-25)17-22-13-11(16(21)23-17)9-12(20)14(28-3)15(13)29-4/h9,27H,5-8,10H2,1-4H3,(H2,21,22,23)