2-methyl-2-phenyl-hexanedioic acid

Systemtic Name: 2-methyl-2-phenyl-hexanedioic acid Openeye Name: 2-methyl-2-phenyl-hexanedioic acid CAS Name: 2-methyl-2-phenylhexanedioic acid IUPAC Name: 2-methyl-2-phenylhexanedioic acid Traditional Name: 2-methyl-2-phenyl-adipic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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