5-bromanyl-1,3-bis[(4-methoxy-3-nitro-phenyl)methyl]pyrimidine-2,4-dione

Systemtic Name: 5-bromanyl-1,3-bis[(4-methoxy-3-nitro-phenyl)methyl]pyrimidine-2,4-dione Openeye Name: 5-bromo-1,3-bis[(4-methoxy-3-nitro-phenyl)methyl]pyrimidine-2,4-dione CAS Name: 5-bromo-1,3-bis[(4-methoxy-3-nitrophenyl)methyl]pyrimidine-2,4-dione IUPAC Name: 5-bromo-1,3-bis[(4-methoxy-3-nitrophenyl)methyl]pyrimidine-2,4-dione Traditional Name: 5-bromo-1,3-bis(4-methoxy-3-nitro-benzyl)pyrimidine-2,4-quinone Formula: C20H17BrN4O8 MolecularWeight: 521.27498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C=C(C(=O)N(C2=O)CC3=CC(=C(C=C3)OC)[N+](=O)[O-])Br)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C=C(C(=O)N(C2=O)CC3=CC(=C(C=C3)OC)[N+](=O)[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C20H17BrN4O8/c1-32-17-5-3-12(7-15(17)24(28)29)9-22-11-14(21)19(26)23(20(22)27)10-13-4-6-18(33-2)16(8-13)25(30)31/h3-8,11H,9-10H2,1-2H3