3-butyl-2-heptyl-nonanoic acid

Systemtic Name: 3-butyl-2-heptyl-nonanoic acid Openeye Name: 3-butyl-2-heptyl-nonanoic acid CAS Name: 3-butyl-2-heptylnonanoic acid IUPAC Name: 3-butyl-2-heptylnonanoic acid Traditional Name: 3-butyl-2-heptyl-pelargonic acid Formula: C20H40O2 MolecularWeight: 312.5304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C(CCCC)CCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCC(C(CCCC)CCCCCC)C(=O)O

InChI

InChI=1S/C20H40O2/c1-4-7-10-12-14-17-19(20(21)22)18(15-9-6-3)16-13-11-8-5-2/h18-19H,4-17H2,1-3H3,(H,21,22)