N-[(3-methoxyphenyl)methyl]-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(3-methoxyphenyl)methyl]-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-[(3-methoxyphenyl)methyl]-4-methylsulfonyl-2-nitro-aniline CAS Name: N-[(3-methoxyphenyl)methyl]-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[(3-methoxyphenyl)methyl]-4-methylsulfonyl-2-nitroaniline Traditional Name: m-anisyl-(4-mesyl-2-nitro-phenyl)amine Formula: C15H16N2O5S MolecularWeight: 336.36294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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