2-butyl-2-phenyl-propanedioic acid

Systemtic Name: 2-butyl-2-phenyl-propanedioic acid Openeye Name: 2-butyl-2-phenyl-propanedioic acid CAS Name: 2-butyl-2-phenylpropanedioic acid IUPAC Name: 2-butyl-2-phenylpropanedioic acid Traditional Name: 2-butyl-2-phenyl-malonic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=CC=C1)(C(=O)O)C(=O)O

Isomeric SMILES

CCCCC(C1=CC=CC=C1)(C(=O)O)C(=O)O

InChI

InChI=1S/C13H16O4/c1-2-3-9-13(11(14)15,12(16)17)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3,(H,14,15)(H,16,17)