N-(2-methylbutan-2-yl)-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-(2-methylbutan-2-yl)-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-(1,1-dimethylpropyl)-4-methylsulfonyl-2-nitro-aniline CAS Name: N-(2-methylbutan-2-yl)-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-(2-methylbutan-2-yl)-4-methylsulfonyl-2-nitroaniline Traditional Name: tert-amyl-(4-mesyl-2-nitro-phenyl)amine Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC1=C(C=C(C=C1)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCC(C)(C)NC1=C(C=C(C=C1)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C12H18N2O4S/c1-5-12(2,3)13-10-7-6-9(19(4,17)18)8-11(10)14(15)16/h6-8,13H,5H2,1-4H3