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

Systemtic Name: tert-butyl 4-(6-methoxy-7-oxidanylidene-1H-quinazolin-4-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(6-methoxy-7-oxo-1H-quinazolin-4-yl)piperazine-1-carboxylate CAS Name: 4-(6-methoxy-7-oxo-1H-quinazolin-4-yl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(6-methoxy-7-oxo-1H-quinazolin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(7-keto-6-methoxy-1H-quinazolin-4-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C18H24N4O4 MolecularWeight: 360.40756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=C3C=C(C(=O)C=C3NC=N2)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=C3C=C(C(=O)C=C3NC=N2)OC

InChI

InChI=1S/C18H24N4O4/c1-18(2,3)26-17(24)22-7-5-21(6-8-22)16-12-9-15(25-4)14(23)10-13(12)19-11-20-16/h9-11H,5-8H2,1-4H3,(H,19,20)