2-(2-ethylhexyl)decanedioic acid

Systemtic Name: 2-(2-ethylhexyl)decanedioic acid Openeye Name: 2-(2-ethylhexyl)decanedioic acid CAS Name: 2-(2-ethylhexyl)decanedioic acid IUPAC Name: 2-(2-ethylhexyl)decanedioic acid Traditional Name: 2-(2-ethylhexyl)sebacic acid Formula: C18H34O4 MolecularWeight: 314.46016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H34O4/c1-3-5-11-15(4-2)14-16(18(21)22)12-9-7-6-8-10-13-17(19)20/h15-16H,3-14H2,1-2H3,(H,19,20)(H,21,22)