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

Systemtic Name: 8-chloranyl-3-[1-(6,7-dimethoxyquinazolin-4-yl)piperidin-4-yl]-6-nitro-1H-quinazoline-2,4-dione Openeye Name: 8-chloro-3-[1-(6,7-dimethoxyquinazolin-4-yl)-4-piperidyl]-6-nitro-1H-quinazoline-2,4-dione CAS Name: 8-chloro-3-[1-(6,7-dimethoxy-4-quinazolinyl)-4-piperidinyl]-6-nitro-1H-quinazoline-2,4-dione IUPAC Name: 8-chloro-3-[1-(6,7-dimethoxyquinazolin-4-yl)piperidin-4-yl]-6-nitro-1H-quinazoline-2,4-dione Traditional Name: 8-chloro-3-[1-(6,7-dimethoxyquinazolin-4-yl)-4-piperidyl]-6-nitro-1H-quinazoline-2,4-quinone Formula: C23H21ClN6O6 MolecularWeight: 512.90244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCC(CC3)N4C(=O)C5=CC(=CC(=C5NC4=O)Cl)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCC(CC3)N4C(=O)C5=CC(=CC(=C5NC4=O)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C23H21ClN6O6/c1-35-18-9-14-17(10-19(18)36-2)25-11-26-21(14)28-5-3-12(4-6-28)29-22(31)15-7-13(30(33)34)8-16(24)20(15)27-23(29)32/h7-12H,3-6H2,1-2H3,(H,27,32)