N-(2-methyl-2-nitro-propyl)-4-methylsulfonyl-aniline

Systemtic Name: N-(2-methyl-2-nitro-propyl)-4-methylsulfonyl-aniline Openeye Name: N-(2-methyl-2-nitro-propyl)-4-methylsulfonyl-aniline CAS Name: N-(2-methyl-2-nitropropyl)-4-methylsulfonylaniline IUPAC Name: N-(2-methyl-2-nitropropyl)-4-methylsulfonylaniline Traditional Name: (4-mesylphenyl)-(2-methyl-2-nitro-propyl)amine Formula: C11H16N2O4S MolecularWeight: 272.32074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=CC=C(C=C1)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)(CNC1=CC=C(C=C1)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C11H16N2O4S/c1-11(2,13(14)15)8-12-9-4-6-10(7-5-9)18(3,16)17/h4-7,12H,8H2,1-3H3