3-[3-[2-ethyl-4-(4-fluorophenyl)-5-phenylmethoxy-phenoxy]propoxy]-3,4-dihydro-2H-chromene-2-carboxylic acid

Systemtic Name: 3-[3-[2-ethyl-4-(4-fluorophenyl)-5-phenylmethoxy-phenoxy]propoxy]-3,4-dihydro-2H-chromene-2-carboxylic acid Openeye Name: 3-[3-[5-benzyloxy-2-ethyl-4-(4-fluorophenyl)phenoxy]propoxy]chromane-2-carboxylic acid CAS Name: 3-[3-[2-ethyl-4-(4-fluorophenyl)-5-phenylmethoxyphenoxy]propoxy]-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 3-[3-[2-ethyl-4-(4-fluorophenyl)-5-phenylmethoxyphenoxy]propoxy]-3,4-dihydro-2H-chromene-2-carboxylic acid Traditional Name: 3-[3-[5-benzoxy-2-ethyl-4-(4-fluorophenyl)phenoxy]propoxy]chroman-2-carboxylic acid Formula: C34H33FO6 MolecularWeight: 556.620623

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C2=CC=C(C=C2)F)OCC3=CC=CC=C3)OCCCOC4CC5=CC=CC=C5OC4C(=O)O

Isomeric SMILES

CCC1=C(C=C(C(=C1)C2=CC=C(C=C2)F)OCC3=CC=CC=C3)OCCCOC4CC5=CC=CC=C5OC4C(=O)O

InChI

InChI=1S/C34H33FO6/c1-2-24-19-28(25-13-15-27(35)16-14-25)31(40-22-23-9-4-3-5-10-23)21-30(24)38-17-8-18-39-32-20-26-11-6-7-12-29(26)41-33(32)34(36)37/h3-7,9-16,19,21,32-33H,2,8,17-18,20,22H2,1H3,(H,36,37)