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1-(4-methylphenyl)sulfonyl-3,5-dinitro-1,3,5-triazinane

1-(4-methylphenyl)sulfonyl-3,5-dinitro-1,3,5-triazinane

Systemtic Name:1-(4-methylphenyl)sulfonyl-3,5-dinitro-1,3,5-triazinane
Openeye Name:1,3-dinitro-5-(p-tolylsulfonyl)-1,3,5-triazinane
CAS Name:1-(4-methylphenyl)sulfonyl-3,5-dinitro-1,3,5-triazinane
IUPAC Name:1-(4-methylphenyl)sulfonyl-3,5-dinitro-1,3,5-triazinane
Traditional Name:1,3-dinitro-5-tosyl-1,3,5-triazinane
Formula: C10H13N5O6S
MolecularWeight: 331.30512
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CN(CN(C2)[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CN(CN(C2)[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C10H13N5O6S/c1-9-2-4-10(5-3-9)22(20,21)13-7-11(14(16)17)6-12(8-13)15(18)19/h2-5H,6-8H2,1H3


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