3-(2-methoxyphenoxy)propane-1,2-diol; 2-[4-(2-methylpropyl)phenyl]propanoic acid

Systemtic Name: 3-(2-methoxyphenoxy)propane-1,2-diol; 2-[4-(2-methylpropyl)phenyl]propanoic acid Openeye Name: 2-(4-isobutylphenyl)propanoic acid; 3-(2-methoxyphenoxy)propane-1,2-diol CAS Name: 3-(2-methoxyphenoxy)propane-1,2-diol; 2-[4-(2-methylpropyl)phenyl]propanoic acid IUPAC Name: 3-(2-methoxyphenoxy)propane-1,2-diol; 2-[4-(2-methylpropyl)phenyl]propanoic acid Traditional Name: 2-(4-isobutylphenyl)propionic acid; 3-(2-methoxyphenoxy)propane-1,2-diol Formula: C23H32O6 MolecularWeight: 404.49658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.COC1=CC=CC=C1OCC(CO)O

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.COC1=CC=CC=C1OCC(CO)O

InChI

InChI=1S/C13H18O2.C10H14O4/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15;1-13-9-4-2-3-5-10(9)14-7-8(12)6-11/h4-7,9-10H,8H2,1-3H3,(H,14,15);2-5,8,11-12H,6-7H2,1H3