3-methyl-3-(phenylmethyl)pentanedioic acid

Systemtic Name: 3-methyl-3-(phenylmethyl)pentanedioic acid Openeye Name: 3-benzyl-3-methyl-pentanedioic acid CAS Name: 3-methyl-3-(phenylmethyl)pentanedioic acid IUPAC Name: 3-benzyl-3-methylpentanedioic acid Traditional Name: 3-benzyl-3-methyl-glutaric acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)(CC(=O)O)CC(=O)O

Isomeric SMILES

CC(CC1=CC=CC=C1)(CC(=O)O)CC(=O)O

InChI

InChI=1S/C13H16O4/c1-13(8-11(14)15,9-12(16)17)7-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,14,15)(H,16,17)