9-[2-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperidin-4-yl]-9-azaspiro[5.5]undecane-8,10-dione

Systemtic Name: 9-[2-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperidin-4-yl]-9-azaspiro[5.5]undecane-8,10-dione Openeye Name: 9-[2-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-4-piperidyl]-9-azaspiro[5.5]undecane-8,10-dione CAS Name: 9-[2-(4-amino-6,7-dimethoxy-2-quinazolinyl)-4-piperidinyl]-9-azaspiro[5.5]undecane-8,10-dione IUPAC Name: 9-[2-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperidin-4-yl]-9-azaspiro[5.5]undecane-8,10-dione Traditional Name: 9-[2-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-4-piperidyl]-9-azaspiro[5.5]undecane-8,10-quinone Formula: C25H33N5O4 MolecularWeight: 467.56062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C3CC(CCN3)N4C(=O)CC5(CCCCC5)CC4=O)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C3CC(CCN3)N4C(=O)CC5(CCCCC5)CC4=O)N)OC

InChI

InChI=1S/C25H33N5O4/c1-33-19-11-16-17(12-20(19)34-2)28-24(29-23(16)26)18-10-15(6-9-27-18)30-21(31)13-25(14-22(30)32)7-4-3-5-8-25/h11-12,15,18,27H,3-10,13-14H2,1-2H3,(H2,26,28,29)