N-[4-(cyanomethyl)phenyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide Openeye Name: N-[4-(cyanomethyl)phenyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide CAS Name: N-[4-(cyanomethyl)phenyl]-4-methoxy-2,3,6-trimethylbenzenesulfonamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-4-methoxy-2,3,6-trimethylbenzenesulfonamide Traditional Name: N-[4-(cyanomethyl)phenyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide Formula: C18H20N2O3S MolecularWeight: 344.428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)NC2=CC=C(C=C2)CC#N)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)NC2=CC=C(C=C2)CC#N)C)C)OC

InChI

InChI=1S/C18H20N2O3S/c1-12-11-17(23-4)13(2)14(3)18(12)24(21,22)20-16-7-5-15(6-8-16)9-10-19/h5-8,11,20H,9H2,1-4H3