4-[1-[2,3-bis(phenylmethoxy)phenyl]hexoxy]-3-chloranyl-benzoic acid

Systemtic Name: 4-[1-[2,3-bis(phenylmethoxy)phenyl]hexoxy]-3-chloranyl-benzoic acid Openeye Name: 3-chloro-4-[1-(2,3-dibenzyloxyphenyl)hexoxy]benzoic acid CAS Name: 4-[1-[2,3-bis(phenylmethoxy)phenyl]hexoxy]-3-chlorobenzoic acid IUPAC Name: 4-[1-[2,3-bis(phenylmethoxy)phenyl]hexoxy]-3-chlorobenzoic acid Traditional Name: 3-chloro-4-[1-(2,3-dibenzoxyphenyl)hexoxy]benzoic acid Formula: C33H33ClO5 MolecularWeight: 545.06512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=C(C(=CC=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3)OC4=C(C=C(C=C4)C(=O)O)Cl

Isomeric SMILES

CCCCCC(C1=C(C(=CC=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3)OC4=C(C=C(C=C4)C(=O)O)Cl

InChI

InChI=1S/C33H33ClO5/c1-2-3-6-17-29(39-30-20-19-26(33(35)36)21-28(30)34)27-16-11-18-31(37-22-24-12-7-4-8-13-24)32(27)38-23-25-14-9-5-10-15-25/h4-5,7-16,18-21,29H,2-3,6,17,22-23H2,1H3,(H,35,36)