2-methylsulfonyl-N-[(3-nitrophenyl)methyl]aniline

Systemtic Name: 2-methylsulfonyl-N-[(3-nitrophenyl)methyl]aniline Openeye Name: 2-methylsulfonyl-N-[(3-nitrophenyl)methyl]aniline CAS Name: 2-methylsulfonyl-N-[(3-nitrophenyl)methyl]aniline IUPAC Name: 2-methylsulfonyl-N-[(3-nitrophenyl)methyl]aniline Traditional Name: (2-mesylphenyl)-(3-nitrobenzyl)amine Formula: C14H14N2O4S MolecularWeight: 306.33696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1NCC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1NCC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H14N2O4S/c1-21(19,20)14-8-3-2-7-13(14)15-10-11-5-4-6-12(9-11)16(17)18/h2-9,15H,10H2,1H3