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

Systemtic Name: (2R)-7-[3-(2-chloranyl-4-phenoxy-phenoxy)propoxy]-2-ethyl-3,4-dihydrochromene-2-carboxylic acid Openeye Name: (2R)-7-[3-(2-chloro-4-phenoxy-phenoxy)propoxy]-2-ethyl-chromane-2-carboxylic acid CAS Name: (2R)-7-[3-(2-chloro-4-phenoxyphenoxy)propoxy]-2-ethyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: (2R)-7-[3-(2-chloro-4-phenoxyphenoxy)propoxy]-2-ethyl-3,4-dihydrochromene-2-carboxylic acid Traditional Name: (2R)-7-[3-(2-chloro-4-phenoxy-phenoxy)propoxy]-2-ethyl-chroman-2-carboxylic acid Formula: C27H27ClO6 MolecularWeight: 482.95268

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCC2=C(O1)C=C(C=C2)OCCCOC3=C(C=C(C=C3)OC4=CC=CC=C4)Cl)C(=O)O

Isomeric SMILES

CC[C@@]1(CCC2=C(O1)C=C(C=C2)OCCCOC3=C(C=C(C=C3)OC4=CC=CC=C4)Cl)C(=O)O

InChI

InChI=1S/C27H27ClO6/c1-2-27(26(29)30)14-13-19-9-10-21(18-25(19)34-27)31-15-6-16-32-24-12-11-22(17-23(24)28)33-20-7-4-3-5-8-20/h3-5,7-12,17-18H,2,6,13-16H2,1H3,(H,29,30)/t27-/m1/s1