5-chloranylsulfonyloxy-2-methyl-1,3-dinitro-benzene

Systemtic Name: 5-chloranylsulfonyloxy-2-methyl-1,3-dinitro-benzene Openeye Name: 5-chlorosulfonyloxy-2-methyl-1,3-dinitro-benzene CAS Name: 5-chlorosulfonyloxy-2-methyl-1,3-dinitrobenzene IUPAC Name: 5-chlorosulfonyloxy-2-methyl-1,3-dinitrobenzene Traditional Name: 5-chlorosulfonyloxy-2-methyl-1,3-dinitro-benzene Formula: C7H5ClN2O7S MolecularWeight: 296.6418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H5ClN2O7S/c1-4-6(9(11)12)2-5(17-18(8,15)16)3-7(4)10(13)14/h2-3H,1H3