4-methyl-1,2-dinitro-benzene; sulfurochloridic acid

Systemtic Name: 4-methyl-1,2-dinitro-benzene; sulfurochloridic acid Openeye Name: 4-methyl-1,2-dinitro-benzene; sulfurochloridic acid CAS Name: 4-methyl-1,2-dinitrobenzene; sulfurochloridic acid IUPAC Name: 4-methyl-1,2-dinitrobenzene; sulfurochloridic acid Traditional Name: 4-methyl-1,2-dinitro-benzene; sulfurochloridic acid Formula: C7H7ClN2O7S MolecularWeight: 298.65768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])[N+](=O)[O-].OS(=O)(=O)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])[N+](=O)[O-].OS(=O)(=O)Cl

InChI

InChI=1S/C7H6N2O4.ClHO3S/c1-5-2-3-6(8(10)11)7(4-5)9(12)13;1-5(2,3)4/h2-4H,1H3;(H,2,3,4)