(E)-5-[3-(phenylsulfamoyl)phenyl]pent-2-en-4-ynoic acid

Systemtic Name: (E)-5-[3-(phenylsulfamoyl)phenyl]pent-2-en-4-ynoic acid Openeye Name: (E)-5-[3-(phenylsulfamoyl)phenyl]pent-2-en-4-ynoic acid CAS Name: (E)-5-[3-(phenylsulfamoyl)phenyl]pent-2-en-4-ynoic acid IUPAC Name: (E)-5-[3-(phenylsulfamoyl)phenyl]pent-2-en-4-ynoic acid Traditional Name: (E)-5-[3-(phenylsulfamoyl)phenyl]pent-2-en-4-ynoic acid Formula: C17H13NO4S MolecularWeight: 327.35442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C#CC=CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C#C/C=C/C(=O)O

InChI

InChI=1S/C17H13NO4S/c19-17(20)12-5-4-7-14-8-6-11-16(13-14)23(21,22)18-15-9-2-1-3-10-15/h1-3,5-6,8-13,18H,(H,19,20)/b12-5+