2-[(4-propan-2-yloxyphenyl)methyl]propanedioic acid

Systemtic Name: 2-[(4-propan-2-yloxyphenyl)methyl]propanedioic acid Openeye Name: 2-[(4-isopropoxyphenyl)methyl]propanedioic acid CAS Name: 2-[(4-propan-2-yloxyphenyl)methyl]propanedioic acid IUPAC Name: 2-[(4-propan-2-yloxyphenyl)methyl]propanedioic acid Traditional Name: 2-(4-isopropoxybenzyl)malonic acid Formula: C13H16O5 MolecularWeight: 252.26314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CC(C(=O)O)C(=O)O

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CC(C(=O)O)C(=O)O

InChI

InChI=1S/C13H16O5/c1-8(2)18-10-5-3-9(4-6-10)7-11(12(14)15)13(16)17/h3-6,8,11H,7H2,1-2H3,(H,14,15)(H,16,17)