methyl (7E,10E,13E)-icosa-7,10,13-trienoate

Systemtic Name: methyl (7E,10E,13E)-icosa-7,10,13-trienoate Openeye Name: methyl (7E,10E,13E)-icosa-7,10,13-trienoate CAS Name: (7E,10E,13E)-eicosa-7,10,13-trienoic acid methyl ester IUPAC Name: methyl (7E,10E,13E)-icosa-7,10,13-trienoate Traditional Name: (7E,10E,13E)-eicosa-7,10,13-trienoic acid methyl ester Formula: C21H36O2 MolecularWeight: 320.50934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CCC=CCC=CCCCCCC(=O)OC

Isomeric SMILES

CCCCCC/C=C/C/C=C/C/C=C/CCCCCC(=O)OC

InChI

InChI=1S/C21H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h8-9,11-12,14-15H,3-7,10,13,16-20H2,1-2H3/b9-8+,12-11+,15-14+