1-[4-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]phenyl]sulfonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-[4-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]phenyl]sulfonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[4-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]phenyl]sulfonylpyrrolidine-2-carboxylic acid CAS Name: 1-[4-[3-(4-phenoxy-2-propylphenoxy)propoxy]phenyl]sulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-[3-(4-phenoxy-2-propylphenoxy)propoxy]phenyl]sulfonylpyrrolidine-2-carboxylic acid Traditional Name: 1-[4-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]phenyl]sulfonylproline Formula: C29H33NO7S MolecularWeight: 539.63982

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)OC2=CC=CC=C2)OCCCOC3=CC=C(C=C3)S(=O)(=O)N4CCCC4C(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1)OC2=CC=CC=C2)OCCCOC3=CC=C(C=C3)S(=O)(=O)N4CCCC4C(=O)O

InChI

InChI=1S/C29H33NO7S/c1-2-8-22-21-25(37-24-9-4-3-5-10-24)14-17-28(22)36-20-7-19-35-23-12-15-26(16-13-23)38(33,34)30-18-6-11-27(30)29(31)32/h3-5,9-10,12-17,21,27H,2,6-8,11,18-20H2,1H3,(H,31,32)