tert-butyl 4-(7-methoxy-6-phenylmethoxy-quinazolin-4-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(7-methoxy-6-phenylmethoxy-quinazolin-4-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(6-benzyloxy-7-methoxy-quinazolin-4-yl)piperazine-1-carboxylate CAS Name: 4-(7-methoxy-6-phenylmethoxy-4-quinazolinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(7-methoxy-6-phenylmethoxyquinazolin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(6-benzoxy-7-methoxy-quinazolin-4-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=NC3=CC(=C(C=C32)OCC4=CC=CC=C4)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=NC3=CC(=C(C=C32)OCC4=CC=CC=C4)OC

InChI

InChI=1S/C25H30N4O4/c1-25(2,3)33-24(30)29-12-10-28(11-13-29)23-19-14-22(32-16-18-8-6-5-7-9-18)21(31-4)15-20(19)26-17-27-23/h5-9,14-15,17H,10-13,16H2,1-4H3