1-[4-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]phenyl]sulfonyl-2,3-dihydroindole-2-carboxylic acid

Systemtic Name: 1-[4-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]phenyl]sulfonyl-2,3-dihydroindole-2-carboxylic acid Openeye Name: 1-[4-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]phenyl]sulfonylindoline-2-carboxylic acid CAS Name: 1-[4-[3-(4-phenoxy-2-propylphenoxy)propoxy]phenyl]sulfonyl-2,3-dihydroindole-2-carboxylic acid IUPAC Name: 1-[4-[3-(4-phenoxy-2-propylphenoxy)propoxy]phenyl]sulfonyl-2,3-dihydroindole-2-carboxylic acid Traditional Name: 1-[4-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]phenyl]sulfonylindoline-2-carboxylic acid Formula: C33H33NO7S MolecularWeight: 587.68262

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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)N4C(CC5=CC=CC=C54)C(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1)OC2=CC=CC=C2)OCCCOC3=CC=C(C=C3)S(=O)(=O)N4C(CC5=CC=CC=C54)C(=O)O

InChI

InChI=1S/C33H33NO7S/c1-2-9-25-22-28(41-27-11-4-3-5-12-27)16-19-32(25)40-21-8-20-39-26-14-17-29(18-15-26)42(37,38)34-30-13-7-6-10-24(30)23-31(34)33(35)36/h3-7,10-19,22,31H,2,8-9,20-21,23H2,1H3,(H,35,36)