2-(7-methyloctan-2-yl)propanedioic acid

Systemtic Name: 2-(7-methyloctan-2-yl)propanedioic acid Openeye Name: 2-(1,6-dimethylheptyl)propanedioic acid CAS Name: 2-(7-methyloctan-2-yl)propanedioic acid IUPAC Name: 2-(7-methyloctan-2-yl)propanedioic acid Traditional Name: 2-(1,6-dimethylheptyl)malonic acid Formula: C12H22O4 MolecularWeight: 230.30068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22O4/c1-8(2)6-4-5-7-9(3)10(11(13)14)12(15)16/h8-10H,4-7H2,1-3H3,(H,13,14)(H,15,16)