1,3-bis[(4-nitrophenyl)sulfonyl]-1,3-diazinan-5-ol

Systemtic Name: 1,3-bis[(4-nitrophenyl)sulfonyl]-1,3-diazinan-5-ol Openeye Name: 1,3-bis[(4-nitrophenyl)sulfonyl]hexahydropyrimidin-5-ol CAS Name: 1,3-bis[(4-nitrophenyl)sulfonyl]-1,3-diazinan-5-ol IUPAC Name: 1,3-bis[(4-nitrophenyl)sulfonyl]-1,3-diazinan-5-ol Traditional Name: 1,3-dinosylhexahydropyrimidin-5-ol Formula: C16H16N4O9S2 MolecularWeight: 472.44964

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CN1S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1C(CN(CN1S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C16H16N4O9S2/c21-14-9-17(30(26,27)15-5-1-12(2-6-15)19(22)23)11-18(10-14)31(28,29)16-7-3-13(4-8-16)20(24)25/h1-8,14,21H,9-11H2