1-methylsulfonyl-4-nitro-2,5-di(propan-2-yl)benzene

Systemtic Name: 1-methylsulfonyl-4-nitro-2,5-di(propan-2-yl)benzene Openeye Name: 1,4-diisopropyl-2-methylsulfonyl-5-nitro-benzene CAS Name: 1-methylsulfonyl-4-nitro-2,5-di(propan-2-yl)benzene IUPAC Name: 1-methylsulfonyl-4-nitro-2,5-di(propan-2-yl)benzene Traditional Name: 1,4-diisopropyl-2-mesyl-5-nitro-benzene Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1S(=O)(=O)C)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC(=C(C=C1S(=O)(=O)C)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H19NO4S/c1-8(2)10-7-13(19(5,17)18)11(9(3)4)6-12(10)14(15)16/h6-9H,1-5H3