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

Systemtic Name: 2-[(4-methylsulfonyl-2-nitro-phenyl)amino]propan-1-ol Openeye Name: 2-(4-methylsulfonyl-2-nitro-anilino)propan-1-ol CAS Name: 2-(4-methylsulfonyl-2-nitroanilino)-1-propanol IUPAC Name: 2-(4-methylsulfonyl-2-nitroanilino)propan-1-ol Traditional Name: 2-(4-mesyl-2-nitro-anilino)propan-1-ol Formula: C10H14N2O5S MolecularWeight: 274.29356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14N2O5S/c1-7(6-13)11-9-4-3-8(18(2,16)17)5-10(9)12(14)15/h3-5,7,11,13H,6H2,1-2H3