4-methyl-4-(phenylcarbonyl)heptanedioic acid

Systemtic Name: 4-methyl-4-(phenylcarbonyl)heptanedioic acid Openeye Name: 4-benzoyl-4-methyl-heptanedioic acid CAS Name: 4-benzoyl-4-methylheptanedioic acid IUPAC Name: 4-benzoyl-4-methylheptanedioic acid Traditional Name: 4-benzoyl-4-methyl-pimelic acid Formula: C15H18O5 MolecularWeight: 278.30042

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)O)(CCC(=O)O)C(=O)C1=CC=CC=C1

Isomeric SMILES

CC(CCC(=O)O)(CCC(=O)O)C(=O)C1=CC=CC=C1

InChI

InChI=1S/C15H18O5/c1-15(9-7-12(16)17,10-8-13(18)19)14(20)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H,16,17)(H,18,19)