[1,3-bis[(4-nitrophenyl)carbonyl]-1,3-diazinan-5-yl]-(4-nitrophenyl)methanone

Systemtic Name: [1,3-bis[(4-nitrophenyl)carbonyl]-1,3-diazinan-5-yl]-(4-nitrophenyl)methanone Openeye Name: [1,3-bis(4-nitrobenzoyl)hexahydropyrimidin-5-yl]-(4-nitrophenyl)methanone CAS Name: [1,3-bis[(4-nitrophenyl)-oxomethyl]-1,3-diazinan-5-yl]-(4-nitrophenyl)methanone IUPAC Name: [1,3-bis(4-nitrobenzoyl)-1,3-diazinan-5-yl]-(4-nitrophenyl)methanone Traditional Name: [1,3-bis(4-nitrobenzoyl)hexahydropyrimidin-5-yl]-(4-nitrophenyl)methanone Formula: C25H19N5O9 MolecularWeight: 533.44646

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C(CN(CN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H19N5O9/c31-23(16-1-7-20(8-2-16)28(34)35)19-13-26(24(32)17-3-9-21(10-4-17)29(36)37)15-27(14-19)25(33)18-5-11-22(12-6-18)30(38)39/h1-12,19H,13-15H2