3-nitro-3-(2,4,6-trimethylphenyl)sulfonyl-1,4-diaza-2-azanidacyclopent-4-ene

Systemtic Name: 3-nitro-3-(2,4,6-trimethylphenyl)sulfonyl-1,4-diaza-2-azanidacyclopent-4-ene Openeye Name: 3-nitro-3-(2,4,6-trimethylphenyl)sulfonyl-1,4-diaza-2-azanidacyclopent-4-ene CAS Name: 3-nitro-3-(2,4,6-trimethylphenyl)sulfonyl-1,4-diaza-2-azanidacyclopent-4-ene IUPAC Name: 3-nitro-3-(2,4,6-trimethylphenyl)sulfonyl-1,4-diaza-2-azanidacyclopent-4-ene Traditional Name: 3-mesitylsulfonyl-3-nitro-1,4-diaza-2-azanidacyclopent-4-ene Formula: C11H13N4O4S- MolecularWeight: 297.31032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)C2([N-]NC=N2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)C2([N-]NC=N2)[N+](=O)[O-])C

InChI

InChI=1S/C11H13N4O4S/c1-7-4-8(2)10(9(3)5-7)20(18,19)11(15(16)17)12-6-13-14-11/h4-6H,1-3H3,(H,12,13)/q-1