3-[1-(3,4-dichlorophenyl)sulfonyl-5-ethoxy-indol-3-yl]propanoic acid

Systemtic Name: 3-[1-(3,4-dichlorophenyl)sulfonyl-5-ethoxy-indol-3-yl]propanoic acid Openeye Name: 3-[1-(3,4-dichlorophenyl)sulfonyl-5-ethoxy-indol-3-yl]propanoic acid CAS Name: 3-[1-(3,4-dichlorophenyl)sulfonyl-5-ethoxy-3-indolyl]propanoic acid IUPAC Name: 3-[1-(3,4-dichlorophenyl)sulfonyl-5-ethoxyindol-3-yl]propanoic acid Traditional Name: 3-[1-(3,4-dichlorophenyl)sulfonyl-5-ethoxy-indol-3-yl]propionic acid Formula: C19H17Cl2NO5S MolecularWeight: 442.31298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C=C2CCC(=O)O)S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C=C2CCC(=O)O)S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H17Cl2NO5S/c1-2-27-13-4-7-18-15(9-13)12(3-8-19(23)24)11-22(18)28(25,26)14-5-6-16(20)17(21)10-14/h4-7,9-11H,2-3,8H2,1H3,(H,23,24)