N-[5-(hydroxymethyl)-2-methyl-phenyl]-1-(2-nitrophenyl)methanesulfonamide

Systemtic Name: N-[5-(hydroxymethyl)-2-methyl-phenyl]-1-(2-nitrophenyl)methanesulfonamide Openeye Name: N-[5-(hydroxymethyl)-2-methyl-phenyl]-1-(2-nitrophenyl)methanesulfonamide CAS Name: N-[5-(hydroxymethyl)-2-methylphenyl]-1-(2-nitrophenyl)methanesulfonamide IUPAC Name: N-[5-(hydroxymethyl)-2-methylphenyl]-1-(2-nitrophenyl)methanesulfonamide Traditional Name: N-(2-methyl-5-methylol-phenyl)-1-(2-nitrophenyl)methanesulfonamide Formula: C15H16N2O5S MolecularWeight: 336.36294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CO)NS(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)CO)NS(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O5S/c1-11-6-7-12(9-18)8-14(11)16-23(21,22)10-13-4-2-3-5-15(13)17(19)20/h2-8,16,18H,9-10H2,1H3