3-[5-methoxy-1-(4-phenoxyphenyl)sulfonyl-indol-3-yl]propanoic acid

Systemtic Name: 3-[5-methoxy-1-(4-phenoxyphenyl)sulfonyl-indol-3-yl]propanoic acid Openeye Name: 3-[5-methoxy-1-(4-phenoxyphenyl)sulfonyl-indol-3-yl]propanoic acid CAS Name: 3-[5-methoxy-1-(4-phenoxyphenyl)sulfonyl-3-indolyl]propanoic acid IUPAC Name: 3-[5-methoxy-1-(4-phenoxyphenyl)sulfonylindol-3-yl]propanoic acid Traditional Name: 3-[5-methoxy-1-(4-phenoxyphenyl)sulfonyl-indol-3-yl]propionic acid Formula: C24H21NO6S MolecularWeight: 451.49164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C=C2CCC(=O)O)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N(C=C2CCC(=O)O)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C24H21NO6S/c1-30-20-10-13-23-22(15-20)17(7-14-24(26)27)16-25(23)32(28,29)21-11-8-19(9-12-21)31-18-5-3-2-4-6-18/h2-6,8-13,15-16H,7,14H2,1H3,(H,26,27)