(E)-octadec-13-en-9-ynoic acid

Systemtic Name: (E)-octadec-13-en-9-ynoic acid Openeye Name: (E)-octadec-13-en-9-ynoic acid CAS Name: (E)-octadec-13-en-9-ynoic acid IUPAC Name: (E)-octadec-13-en-9-ynoic acid Traditional Name: (E)-octadec-13-en-9-ynoic acid Formula: C18H30O2 MolecularWeight: 278.4296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CCCC#CCCCCCCCC(=O)O

Isomeric SMILES

CCCC/C=C/CCC#CCCCCCCCC(=O)O

InChI

InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h5-6H,2-4,7-8,11-17H2,1H3,(H,19,20)/b6-5+