phenyl octadeca-10,12-diynoate

Systemtic Name: phenyl octadeca-10,12-diynoate Openeye Name: phenyl octadeca-10,12-diynoate CAS Name: octadeca-10,12-diynoic acid phenyl ester IUPAC Name: phenyl octadeca-10,12-diynoate Traditional Name: octadeca-10,12-diynoic acid phenyl ester Formula: C24H32O2 MolecularWeight: 352.50968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC#CCCCCCCCCC(=O)OC1=CC=CC=C1

Isomeric SMILES

CCCCCC#CC#CCCCCCCCCC(=O)OC1=CC=CC=C1

InChI

InChI=1S/C24H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-24(25)26-23-20-17-16-18-21-23/h16-18,20-21H,2-5,10-15,19,22H2,1H3