2-[(6-bromanyl-2-methyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-(4-propan-2-yloxyphenyl)butanoic acid

Systemtic Name: 2-[(6-bromanyl-2-methyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-(4-propan-2-yloxyphenyl)butanoic acid Openeye Name: 2-[(6-bromo-2-methyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-(4-isopropoxyphenyl)butanoic acid CAS Name: 2-[(6-bromo-2-methyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-(4-propan-2-yloxyphenyl)butanoic acid IUPAC Name: 2-[(6-bromo-2-methyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-(4-propan-2-yloxyphenyl)butanoic acid Traditional Name: 2-[(6-bromo-2-methyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-(4-isopropoxyphenyl)butyric acid Formula: C23H27BrO5 MolecularWeight: 463.36148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1COC2=C(O1)C=C(C(=C2)Br)CC(CCC3=CC=C(C=C3)OC(C)C)C(=O)O

Isomeric SMILES

CC1COC2=C(O1)C=C(C(=C2)Br)CC(CCC3=CC=C(C=C3)OC(C)C)C(=O)O

InChI

InChI=1S/C23H27BrO5/c1-14(2)28-19-8-5-16(6-9-19)4-7-17(23(25)26)10-18-11-22-21(12-20(18)24)27-13-15(3)29-22/h5-6,8-9,11-12,14-15,17H,4,7,10,13H2,1-3H3,(H,25,26)