methyl (12E,14E,16E,18E)-icosa-12,14,16,18-tetraen-10-ynoate

Systemtic Name: methyl (12E,14E,16E,18E)-icosa-12,14,16,18-tetraen-10-ynoate Openeye Name: methyl (12E,14E,16E,18E)-icosa-12,14,16,18-tetraen-10-ynoate CAS Name: (12E,14E,16E,18E)-eicosa-12,14,16,18-tetraen-10-ynoic acid methyl ester IUPAC Name: methyl (12E,14E,16E,18E)-icosa-12,14,16,18-tetraen-10-ynoate Traditional Name: (12E,14E,16E,18E)-eicosa-12,14,16,18-tetraen-10-ynoic acid methyl ester Formula: C21H30O2 MolecularWeight: 314.4617

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC=CC=CC#CCCCCCCCCC(=O)OC

Isomeric SMILES

C/C=C/C=C/C=C/C=C/C#CCCCCCCCCC(=O)OC

InChI

InChI=1S/C21H30O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h3-10H,13-20H2,1-2H3/b4-3+,6-5+,8-7+,10-9+