2-methyl-2-[(4-methylsulfonyl-2-nitro-phenyl)amino]propan-1-ol

Systemtic Name: 2-methyl-2-[(4-methylsulfonyl-2-nitro-phenyl)amino]propan-1-ol Openeye Name: 2-methyl-2-(4-methylsulfonyl-2-nitro-anilino)propan-1-ol CAS Name: 2-methyl-2-(4-methylsulfonyl-2-nitroanilino)-1-propanol IUPAC Name: 2-methyl-2-(4-methylsulfonyl-2-nitroanilino)propan-1-ol Traditional Name: 2-(4-mesyl-2-nitro-anilino)-2-methyl-propan-1-ol Formula: C11H16N2O5S MolecularWeight: 288.32014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O5S/c1-11(2,7-14)12-9-5-4-8(19(3,17)18)6-10(9)13(15)16/h4-6,12,14H,7H2,1-3H3