N-[(4-methoxyphenyl)methyl]-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(4-methoxyphenyl)methyl]-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-[(4-methoxyphenyl)methyl]-4-methylsulfonyl-2-nitro-aniline CAS Name: N-[(4-methoxyphenyl)methyl]-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[(4-methoxyphenyl)methyl]-4-methylsulfonyl-2-nitroaniline Traditional Name: (4-mesyl-2-nitro-phenyl)-p-anisyl-amine Formula: C15H16N2O5S MolecularWeight: 336.36294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O5S/c1-22-12-5-3-11(4-6-12)10-16-14-8-7-13(23(2,20)21)9-15(14)17(18)19/h3-9,16H,10H2,1-2H3