5-nitro-2-(phenylsulfonylmethyl)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(phenylsulfonylmethyl)benzenecarbonitrile Openeye Name: 2-(benzenesulfonylmethyl)-5-nitro-benzonitrile CAS Name: 2-(benzenesulfonylmethyl)-5-nitrobenzonitrile IUPAC Name: 2-(benzenesulfonylmethyl)-5-nitrobenzonitrile Traditional Name: 2-(besylmethyl)-5-nitro-benzonitrile Formula: C14H10N2O4S MolecularWeight: 302.3052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10N2O4S/c15-9-12-8-13(16(17)18)7-6-11(12)10-21(19,20)14-4-2-1-3-5-14/h1-8H,10H2