1-(6,7-dimethoxyquinazolin-4-yl)-6-nitro-3-piperidin-3-yl-quinazoline-2,4-dione

Systemtic Name: 1-(6,7-dimethoxyquinazolin-4-yl)-6-nitro-3-piperidin-3-yl-quinazoline-2,4-dione Openeye Name: 1-(6,7-dimethoxyquinazolin-4-yl)-6-nitro-3-(3-piperidyl)quinazoline-2,4-dione CAS Name: 1-(6,7-dimethoxy-4-quinazolinyl)-6-nitro-3-(3-piperidinyl)quinazoline-2,4-dione IUPAC Name: 1-(6,7-dimethoxyquinazolin-4-yl)-6-nitro-3-piperidin-3-ylquinazoline-2,4-dione Traditional Name: 1-(6,7-dimethoxyquinazolin-4-yl)-6-nitro-3-(3-piperidyl)quinazoline-2,4-quinone Formula: C23H22N6O6 MolecularWeight: 478.45738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3C4=C(C=C(C=C4)[N+](=O)[O-])C(=O)N(C3=O)C5CCCNC5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3C4=C(C=C(C=C4)[N+](=O)[O-])C(=O)N(C3=O)C5CCCNC5)OC

InChI

InChI=1S/C23H22N6O6/c1-34-19-9-15-17(10-20(19)35-2)25-12-26-21(15)28-18-6-5-13(29(32)33)8-16(18)22(30)27(23(28)31)14-4-3-7-24-11-14/h5-6,8-10,12,14,24H,3-4,7,11H2,1-2H3