3-heptyl-2,2-dimethyl-butanedioic acid

Systemtic Name: 3-heptyl-2,2-dimethyl-butanedioic acid Openeye Name: 3-heptyl-2,2-dimethyl-butanedioic acid CAS Name: 3-heptyl-2,2-dimethylbutanedioic acid IUPAC Name: 3-heptyl-2,2-dimethylbutanedioic acid Traditional Name: 3-heptyl-2,2-dimethyl-succinic acid Formula: C13H24O4 MolecularWeight: 244.32726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C(=O)O)C(C)(C)C(=O)O

Isomeric SMILES

CCCCCCCC(C(=O)O)C(C)(C)C(=O)O

InChI

InChI=1S/C13H24O4/c1-4-5-6-7-8-9-10(11(14)15)13(2,3)12(16)17/h10H,4-9H2,1-3H3,(H,14,15)(H,16,17)