7-[3-[2-chloranyl-4-(2-methylpropyl)phenoxy]propoxy]-2-methyl-3,4-dihydrochromene-2-carboxylic acid

Systemtic Name: 7-[3-[2-chloranyl-4-(2-methylpropyl)phenoxy]propoxy]-2-methyl-3,4-dihydrochromene-2-carboxylic acid Openeye Name: 7-[3-(2-chloro-4-isobutyl-phenoxy)propoxy]-2-methyl-chromane-2-carboxylic acid CAS Name: 7-[3-[2-chloro-4-(2-methylpropyl)phenoxy]propoxy]-2-methyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[3-[2-chloro-4-(2-methylpropyl)phenoxy]propoxy]-2-methyl-3,4-dihydrochromene-2-carboxylic acid Traditional Name: 7-[3-(2-chloro-4-isobutyl-phenoxy)propoxy]-2-methyl-chroman-2-carboxylic acid Formula: C24H29ClO5 MolecularWeight: 432.93706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=C(C=C1)OCCCOC2=CC3=C(CCC(O3)(C)C(=O)O)C=C2)Cl

Isomeric SMILES

CC(C)CC1=CC(=C(C=C1)OCCCOC2=CC3=C(CCC(O3)(C)C(=O)O)C=C2)Cl

InChI

InChI=1S/C24H29ClO5/c1-16(2)13-17-5-8-21(20(25)14-17)29-12-4-11-28-19-7-6-18-9-10-24(3,23(26)27)30-22(18)15-19/h5-8,14-16H,4,9-13H2,1-3H3,(H,26,27)