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

Systemtic Name: 1-[3-chloranyl-4-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]phenyl]sulfonyl-2,3-dihydroindole-2-carboxylic acid Openeye Name: 1-[3-chloro-4-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]phenyl]sulfonylindoline-2-carboxylic acid CAS Name: 1-[3-chloro-4-[3-(4-phenoxy-2-propylphenoxy)propoxy]phenyl]sulfonyl-2,3-dihydroindole-2-carboxylic acid IUPAC Name: 1-[3-chloro-4-[3-(4-phenoxy-2-propylphenoxy)propoxy]phenyl]sulfonyl-2,3-dihydroindole-2-carboxylic acid Traditional Name: 1-[3-chloro-4-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]phenyl]sulfonylindoline-2-carboxylic acid Formula: C33H32ClNO7S MolecularWeight: 622.12768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H32ClNO7S/c1-2-9-24-20-26(42-25-11-4-3-5-12-25)14-16-31(24)40-18-8-19-41-32-17-15-27(22-28(32)34)43(38,39)35-29-13-7-6-10-23(29)21-30(35)33(36)37/h3-7,10-17,20,22,30H,2,8-9,18-19,21H2,1H3,(H,36,37)