N-[4-(cyanomethyl)phenyl]-2-methoxy-5-sulfamoyl-benzamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-methoxy-5-sulfamoyl-benzamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-methoxy-5-sulfamoyl-benzamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-methoxy-5-sulfamoylbenzamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-methoxy-5-sulfamoylbenzamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-methoxy-5-sulfamoyl-benzamide Formula: C16H15N3O4S MolecularWeight: 345.373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)NC2=CC=C(C=C2)CC#N

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)NC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C16H15N3O4S/c1-23-15-7-6-13(24(18,21)22)10-14(15)16(20)19-12-4-2-11(3-5-12)8-9-17/h2-7,10H,8H2,1H3,(H,19,20)(H2,18,21,22)