1-(2-chloranyl-6,7-diethoxy-quinazolin-4-yl)-6-nitro-3-piperidin-4-yl-quinazoline-2,4-dione

Systemtic Name: 1-(2-chloranyl-6,7-diethoxy-quinazolin-4-yl)-6-nitro-3-piperidin-4-yl-quinazoline-2,4-dione Openeye Name: 1-(2-chloro-6,7-diethoxy-quinazolin-4-yl)-6-nitro-3-(4-piperidyl)quinazoline-2,4-dione CAS Name: 1-(2-chloro-6,7-diethoxy-4-quinazolinyl)-6-nitro-3-(4-piperidinyl)quinazoline-2,4-dione IUPAC Name: 1-(2-chloro-6,7-diethoxyquinazolin-4-yl)-6-nitro-3-piperidin-4-ylquinazoline-2,4-dione Traditional Name: 1-(2-chloro-6,7-diethoxy-quinazolin-4-yl)-6-nitro-3-(4-piperidyl)quinazoline-2,4-quinone Formula: C25H25ClN6O6 MolecularWeight: 540.9556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=NC(=N2)Cl)N3C4=C(C=C(C=C4)[N+](=O)[O-])C(=O)N(C3=O)C5CCNCC5)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=NC(=N2)Cl)N3C4=C(C=C(C=C4)[N+](=O)[O-])C(=O)N(C3=O)C5CCNCC5)OCC

InChI

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