3-[4-[[4-methoxy-3-(phenylmethyl)phenyl]sulfamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[[4-methoxy-3-(phenylmethyl)phenyl]sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[(3-benzyl-4-methoxy-phenyl)sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[[4-methoxy-3-(phenylmethyl)phenyl]sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[(3-benzyl-4-methoxyphenyl)sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[(3-benzyl-4-methoxy-phenyl)sulfamoyl]phenyl]propionic acid Formula: C23H23NO5S MolecularWeight: 425.49742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)CCC(=O)O)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)CCC(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C23H23NO5S/c1-29-22-13-10-20(16-19(22)15-18-5-3-2-4-6-18)24-30(27,28)21-11-7-17(8-12-21)9-14-23(25)26/h2-8,10-13,16,24H,9,14-15H2,1H3,(H,25,26)