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

Systemtic Name: (2R)-7-[3-(2-chloranyl-4-methoxy-phenoxy)propoxy]-2-methyl-3,4-dihydrochromene-2-carboxylic acid Openeye Name: (2R)-7-[3-(2-chloro-4-methoxy-phenoxy)propoxy]-2-methyl-chromane-2-carboxylic acid CAS Name: (2R)-7-[3-(2-chloro-4-methoxyphenoxy)propoxy]-2-methyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: (2R)-7-[3-(2-chloro-4-methoxyphenoxy)propoxy]-2-methyl-3,4-dihydrochromene-2-carboxylic acid Traditional Name: (2R)-7-[3-(2-chloro-4-methoxy-phenoxy)propoxy]-2-methyl-chroman-2-carboxylic acid Formula: C21H23ClO6 MolecularWeight: 406.85672

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(O1)C=C(C=C2)OCCCOC3=C(C=C(C=C3)OC)Cl)C(=O)O

Isomeric SMILES

C[C@@]1(CCC2=C(O1)C=C(C=C2)OCCCOC3=C(C=C(C=C3)OC)Cl)C(=O)O

InChI

InChI=1S/C21H23ClO6/c1-21(20(23)24)9-8-14-4-5-16(13-19(14)28-21)26-10-3-11-27-18-7-6-15(25-2)12-17(18)22/h4-7,12-13H,3,8-11H2,1-2H3,(H,23,24)/t21-/m1/s1