2-[[4-(4-phenoxyphenyl)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid

Systemtic Name: 2-[[4-(4-phenoxyphenyl)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid Openeye Name: 2-[[4-(4-phenoxyphenyl)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid CAS Name: 2-[[4-(4-phenoxyphenyl)phenyl]sulfonylamino]-5-phenyl-4-pentynoic acid IUPAC Name: 2-[[4-(4-phenoxyphenyl)phenyl]sulfonylamino]-5-phenylpent-4-ynoic acid Traditional Name: 2-[[4-(4-phenoxyphenyl)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid Formula: C29H23NO5S MolecularWeight: 497.56162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CCC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C#CCC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C29H23NO5S/c31-29(32)28(13-7-10-22-8-3-1-4-9-22)30-36(33,34)27-20-16-24(17-21-27)23-14-18-26(19-15-23)35-25-11-5-2-6-12-25/h1-6,8-9,11-12,14-21,28,30H,13H2,(H,31,32)