2,4-dimethyl-4-phenyl-octanedioic acid

Systemtic Name: 2,4-dimethyl-4-phenyl-octanedioic acid Openeye Name: 2,4-dimethyl-4-phenyl-octanedioic acid CAS Name: 2,4-dimethyl-4-phenyloctanedioic acid IUPAC Name: 2,4-dimethyl-4-phenyloctanedioic acid Traditional Name: 2,4-dimethyl-4-phenyl-suberic acid Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)(CCCC(=O)O)C1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(CC(C)(CCCC(=O)O)C1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C16H22O4/c1-12(15(19)20)11-16(2,10-6-9-14(17)18)13-7-4-3-5-8-13/h3-5,7-8,12H,6,9-11H2,1-2H3,(H,17,18)(H,19,20)