2,4-dimethyl-1,3-dinitro-5-propan-2-ylsulfonyl-benzene

Systemtic Name: 2,4-dimethyl-1,3-dinitro-5-propan-2-ylsulfonyl-benzene Openeye Name: 1-isopropylsulfonyl-2,4-dimethyl-3,5-dinitro-benzene CAS Name: 2,4-dimethyl-1,3-dinitro-5-propan-2-ylsulfonylbenzene IUPAC Name: 2,4-dimethyl-1,3-dinitro-5-propan-2-ylsulfonylbenzene Traditional Name: 1-isopropylsulfonyl-2,4-dimethyl-3,5-dinitro-benzene Formula: C11H14N2O6S MolecularWeight: 302.30366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O6S/c1-6(2)20(18,19)10-5-9(12(14)15)7(3)11(8(10)4)13(16)17/h5-6H,1-4H3