5-chloranyl-1,3-bis[(4-nitrophenyl)methyl]pyrimidine-2,4-dione

Systemtic Name: 5-chloranyl-1,3-bis[(4-nitrophenyl)methyl]pyrimidine-2,4-dione Openeye Name: 5-chloro-1,3-bis[(4-nitrophenyl)methyl]pyrimidine-2,4-dione CAS Name: 5-chloro-1,3-bis[(4-nitrophenyl)methyl]pyrimidine-2,4-dione IUPAC Name: 5-chloro-1,3-bis[(4-nitrophenyl)methyl]pyrimidine-2,4-dione Traditional Name: 5-chloro-1,3-bis(4-nitrobenzyl)pyrimidine-2,4-quinone Formula: C18H13ClN4O6 MolecularWeight: 416.77202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=C(C(=O)N(C2=O)CC3=CC=C(C=C3)[N+](=O)[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CN2C=C(C(=O)N(C2=O)CC3=CC=C(C=C3)[N+](=O)[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H13ClN4O6/c19-16-11-20(9-12-1-5-14(6-2-12)22(26)27)18(25)21(17(16)24)10-13-3-7-15(8-4-13)23(28)29/h1-8,11H,9-10H2