7-[3-[4-(4-chloranylphenoxy)-2-propyl-phenoxy]propoxy]-2-ethyl-3,4-dihydrochromene-2-carboxylic acid

Systemtic Name: 7-[3-[4-(4-chloranylphenoxy)-2-propyl-phenoxy]propoxy]-2-ethyl-3,4-dihydrochromene-2-carboxylic acid Openeye Name: 7-[3-[4-(4-chlorophenoxy)-2-propyl-phenoxy]propoxy]-2-ethyl-chromane-2-carboxylic acid CAS Name: 7-[3-[4-(4-chlorophenoxy)-2-propylphenoxy]propoxy]-2-ethyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[3-[4-(4-chlorophenoxy)-2-propylphenoxy]propoxy]-2-ethyl-3,4-dihydrochromene-2-carboxylic acid Traditional Name: 7-[3-[4-(4-chlorophenoxy)-2-propyl-phenoxy]propoxy]-2-ethyl-chroman-2-carboxylic acid Formula: C30H33ClO6 MolecularWeight: 525.03242

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)OC2=CC=C(C=C2)Cl)OCCCOC3=CC4=C(CCC(O4)(CC)C(=O)O)C=C3

Isomeric SMILES

CCCC1=C(C=CC(=C1)OC2=CC=C(C=C2)Cl)OCCCOC3=CC4=C(CCC(O4)(CC)C(=O)O)C=C3

InChI

InChI=1S/C30H33ClO6/c1-3-6-22-19-26(36-24-11-8-23(31)9-12-24)13-14-27(22)35-18-5-17-34-25-10-7-21-15-16-30(4-2,29(32)33)37-28(21)20-25/h7-14,19-20H,3-6,15-18H2,1-2H3,(H,32,33)