N,N-bis(cyanomethyl)-1-(3-nitrophenyl)methanesulfonamide

Systemtic Name: N,N-bis(cyanomethyl)-1-(3-nitrophenyl)methanesulfonamide Openeye Name: N,N-bis(cyanomethyl)-1-(3-nitrophenyl)methanesulfonamide CAS Name: N,N-bis(cyanomethyl)-1-(3-nitrophenyl)methanesulfonamide IUPAC Name: N,N-bis(cyanomethyl)-1-(3-nitrophenyl)methanesulfonamide Traditional Name: N,N-bis(cyanomethyl)-1-(3-nitrophenyl)methanesulfonamide Formula: C11H10N4O4S MolecularWeight: 294.2865

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10N4O4S/c12-4-6-14(7-5-13)20(18,19)9-10-2-1-3-11(8-10)15(16)17/h1-3,8H,6-7,9H2