1-[(E)-2-[(4-methylphenyl)methylsulfonyl]ethenyl]-3-nitro-benzene

Systemtic Name: 1-[(E)-2-[(4-methylphenyl)methylsulfonyl]ethenyl]-3-nitro-benzene Openeye Name: 1-nitro-3-[(E)-2-(p-tolylmethylsulfonyl)vinyl]benzene CAS Name: 1-[(E)-2-[(4-methylphenyl)methylsulfonyl]ethenyl]-3-nitrobenzene IUPAC Name: 1-[(E)-2-[(4-methylphenyl)methylsulfonyl]ethenyl]-3-nitrobenzene Traditional Name: 1-[(E)-2-(4-methylbenzyl)sulfonylvinyl]-3-nitro-benzene Formula: C16H15NO4S MolecularWeight: 317.3596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H15NO4S/c1-13-5-7-15(8-6-13)12-22(20,21)10-9-14-3-2-4-16(11-14)17(18)19/h2-11H,12H2,1H3/b10-9+