4-(2-chloranyl-5-methoxy-phenoxy)-3-[(4-methoxyphenyl)sulfonylamino]-5-[2-(oxan-2-yloxy)ethoxy]benzoic acid

Systemtic Name: 4-(2-chloranyl-5-methoxy-phenoxy)-3-[(4-methoxyphenyl)sulfonylamino]-5-[2-(oxan-2-yloxy)ethoxy]benzoic acid Openeye Name: 4-(2-chloro-5-methoxy-phenoxy)-3-[(4-methoxyphenyl)sulfonylamino]-5-(2-tetrahydropyran-2-yloxyethoxy)benzoic acid CAS Name: 4-(2-chloro-5-methoxyphenoxy)-3-[(4-methoxyphenyl)sulfonylamino]-5-[2-(2-oxanyloxy)ethoxy]benzoic acid IUPAC Name: 4-(2-chloro-5-methoxyphenoxy)-3-[(4-methoxyphenyl)sulfonylamino]-5-[2-(oxan-2-yloxy)ethoxy]benzoic acid Traditional Name: 4-(2-chloro-5-methoxy-phenoxy)-3-[(4-methoxyphenyl)sulfonylamino]-5-(2-tetrahydropyran-2-yloxyethoxy)benzoic acid Formula: C28H30ClNO10S MolecularWeight: 608.0565

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=CC(=C2)C(=O)O)OCCOC3CCCCO3)OC4=C(C=CC(=C4)OC)Cl

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=CC(=C2)C(=O)O)OCCOC3CCCCO3)OC4=C(C=CC(=C4)OC)Cl

InChI

InChI=1S/C28H30ClNO10S/c1-35-19-6-9-21(10-7-19)41(33,34)30-23-15-18(28(31)32)16-25(37-13-14-39-26-5-3-4-12-38-26)27(23)40-24-17-20(36-2)8-11-22(24)29/h6-11,15-17,26,30H,3-5,12-14H2,1-2H3,(H,31,32)