2-methyl-4-[2-methyl-3-(4-oxidanylbutyl)phenyl]-1,3-dioxolane-4-carboxylic acid

Systemtic Name: 2-methyl-4-[2-methyl-3-(4-oxidanylbutyl)phenyl]-1,3-dioxolane-4-carboxylic acid Openeye Name: 4-[3-(4-hydroxybutyl)-2-methyl-phenyl]-2-methyl-1,3-dioxolane-4-carboxylic acid CAS Name: 4-[3-(4-hydroxybutyl)-2-methylphenyl]-2-methyl-1,3-dioxolane-4-carboxylic acid IUPAC Name: 4-[3-(4-hydroxybutyl)-2-methylphenyl]-2-methyl-1,3-dioxolane-4-carboxylic acid Traditional Name: 4-[3-(4-hydroxybutyl)-2-methyl-phenyl]-2-methyl-1,3-dioxolane-4-carboxylic acid Formula: C16H22O5 MolecularWeight: 294.34288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1OCC(O1)(C2=C(C(=CC=C2)CCCCO)C)C(=O)O

Isomeric SMILES

CC1OCC(O1)(C2=C(C(=CC=C2)CCCCO)C)C(=O)O

InChI

InChI=1S/C16H22O5/c1-11-13(6-3-4-9-17)7-5-8-14(11)16(15(18)19)10-20-12(2)21-16/h5,7-8,12,17H,3-4,6,9-10H2,1-2H3,(H,18,19)