tert-butyl 4-[6-(cyanomethoxy)-7-methoxy-quinazolin-4-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[6-(cyanomethoxy)-7-methoxy-quinazolin-4-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[6-(cyanomethoxy)-7-methoxy-quinazolin-4-yl]piperazine-1-carboxylate CAS Name: 4-[6-(cyanomethoxy)-7-methoxy-4-quinazolinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[6-(cyanomethoxy)-7-methoxyquinazolin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[6-(cyanomethoxy)-7-methoxy-quinazolin-4-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=NC3=CC(=C(C=C32)OCC#N)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=NC3=CC(=C(C=C32)OCC#N)OC

InChI

InChI=1S/C20H25N5O4/c1-20(2,3)29-19(26)25-8-6-24(7-9-25)18-14-11-17(28-10-5-21)16(27-4)12-15(14)22-13-23-18/h11-13H,6-10H2,1-4H3