4-[[4-[(E)-3-thiophen-3-ylprop-2-enoyl]phenyl]sulfonylamino]benzoic acid

Systemtic Name: 4-[[4-[(E)-3-thiophen-3-ylprop-2-enoyl]phenyl]sulfonylamino]benzoic acid Openeye Name: 4-[[4-[(E)-3-(3-thienyl)prop-2-enoyl]phenyl]sulfonylamino]benzoic acid CAS Name: 4-[[4-[(E)-1-oxo-3-(3-thiophenyl)prop-2-enyl]phenyl]sulfonylamino]benzoic acid IUPAC Name: 4-[[4-[(E)-3-thiophen-3-ylprop-2-enoyl]phenyl]sulfonylamino]benzoic acid Traditional Name: 4-[[4-[(E)-3-(3-thienyl)acryloyl]phenyl]sulfonylamino]benzoic acid Formula: C20H15NO5S2 MolecularWeight: 413.4668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C(=O)C=CC3=CSC=C3

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C(=O)/C=C/C3=CSC=C3

InChI

InChI=1S/C20H15NO5S2/c22-19(10-1-14-11-12-27-13-14)15-4-8-18(9-5-15)28(25,26)21-17-6-2-16(3-7-17)20(23)24/h1-13,21H,(H,23,24)/b10-1+