2-(7-methylundecan-5-yl)propanedioic acid

Systemtic Name: 2-(7-methylundecan-5-yl)propanedioic acid Openeye Name: 2-(1-butyl-3-methyl-heptyl)propanedioic acid CAS Name: 2-(7-methylundecan-5-yl)propanedioic acid IUPAC Name: 2-(7-methylundecan-5-yl)propanedioic acid Traditional Name: 2-(1-butyl-3-methyl-heptyl)malonic acid Formula: C15H28O4 MolecularWeight: 272.38042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H28O4/c1-4-6-8-11(3)10-12(9-7-5-2)13(14(16)17)15(18)19/h11-13H,4-10H2,1-3H3,(H,16,17)(H,18,19)