4-fluoranyl-2-[(4-methylphenyl)sulfonylmethyl]-1-nitro-benzene

Systemtic Name: 4-fluoranyl-2-[(4-methylphenyl)sulfonylmethyl]-1-nitro-benzene Openeye Name: 4-fluoro-1-nitro-2-(p-tolylsulfonylmethyl)benzene CAS Name: 4-fluoro-2-[(4-methylphenyl)sulfonylmethyl]-1-nitrobenzene IUPAC Name: 4-fluoro-2-[(4-methylphenyl)sulfonylmethyl]-1-nitrobenzene Traditional Name: 4-fluoro-1-nitro-2-(tosylmethyl)benzene Formula: C14H12FNO4S MolecularWeight: 309.312783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=C(C=CC(=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=C(C=CC(=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C14H12FNO4S/c1-10-2-5-13(6-3-10)21(19,20)9-11-8-12(15)4-7-14(11)16(17)18/h2-8H,9H2,1H3