3-[1-(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)piperidin-4-yl]-1-ethyl-6-nitro-quinazoline-2,4-dione

Systemtic Name: 3-[1-(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)piperidin-4-yl]-1-ethyl-6-nitro-quinazoline-2,4-dione Openeye Name: 3-[1-(2-chloro-6,7-dimethoxy-quinazolin-4-yl)-4-piperidyl]-1-ethyl-6-nitro-quinazoline-2,4-dione CAS Name: 3-[1-(2-chloro-6,7-dimethoxy-4-quinazolinyl)-4-piperidinyl]-1-ethyl-6-nitroquinazoline-2,4-dione IUPAC Name: 3-[1-(2-chloro-6,7-dimethoxyquinazolin-4-yl)piperidin-4-yl]-1-ethyl-6-nitroquinazoline-2,4-dione Traditional Name: 3-[1-(2-chloro-6,7-dimethoxy-quinazolin-4-yl)-4-piperidyl]-1-ethyl-6-nitro-quinazoline-2,4-quinone Formula: C25H25ClN6O6 MolecularWeight: 540.9556

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N(C1=O)C3CCN(CC3)C4=NC(=NC5=CC(=C(C=C54)OC)OC)Cl

Isomeric SMILES

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N(C1=O)C3CCN(CC3)C4=NC(=NC5=CC(=C(C=C54)OC)OC)Cl

InChI

InChI=1S/C25H25ClN6O6/c1-4-30-19-6-5-15(32(35)36)11-17(19)23(33)31(25(30)34)14-7-9-29(10-8-14)22-16-12-20(37-2)21(38-3)13-18(16)27-24(26)28-22/h5-6,11-14H,4,7-10H2,1-3H3