2-(4-methylphenyl)sulfonyl-3-(4-nitrophenyl)prop-2-enenitrile

Systemtic Name: 2-(4-methylphenyl)sulfonyl-3-(4-nitrophenyl)prop-2-enenitrile Openeye Name: 3-(4-nitrophenyl)-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: 2-(4-methylphenyl)sulfonyl-3-(4-nitrophenyl)-2-propenenitrile IUPAC Name: 2-(4-methylphenyl)sulfonyl-3-(4-nitrophenyl)prop-2-enenitrile Traditional Name: 3-(4-nitrophenyl)-2-tosyl-acrylonitrile Formula: C16H12N2O4S MolecularWeight: 328.34248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O4S/c1-12-2-8-15(9-3-12)23(21,22)16(11-17)10-13-4-6-14(7-5-13)18(19)20/h2-10H,1H3