7-chloranyl-3-[1-(6,7-dimethoxyquinazolin-4-yl)piperidin-4-yl]-1H-quinazoline-2,4-dione

Systemtic Name: 7-chloranyl-3-[1-(6,7-dimethoxyquinazolin-4-yl)piperidin-4-yl]-1H-quinazoline-2,4-dione Openeye Name: 7-chloro-3-[1-(6,7-dimethoxyquinazolin-4-yl)-4-piperidyl]-1H-quinazoline-2,4-dione CAS Name: 7-chloro-3-[1-(6,7-dimethoxy-4-quinazolinyl)-4-piperidinyl]-1H-quinazoline-2,4-dione IUPAC Name: 7-chloro-3-[1-(6,7-dimethoxyquinazolin-4-yl)piperidin-4-yl]-1H-quinazoline-2,4-dione Traditional Name: 7-chloro-3-[1-(6,7-dimethoxyquinazolin-4-yl)-4-piperidyl]-1H-quinazoline-2,4-quinone Formula: C23H22ClN5O4 MolecularWeight: 467.90488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCC(CC3)N4C(=O)C5=C(C=C(C=C5)Cl)NC4=O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCC(CC3)N4C(=O)C5=C(C=C(C=C5)Cl)NC4=O)OC

InChI

InChI=1S/C23H22ClN5O4/c1-32-19-10-16-17(11-20(19)33-2)25-12-26-21(16)28-7-5-14(6-8-28)29-22(30)15-4-3-13(24)9-18(15)27-23(29)31/h3-4,9-12,14H,5-8H2,1-2H3,(H,27,31)