methyl 2-phenylmethoxyhexadec-4-ynoate

Systemtic Name: methyl 2-phenylmethoxyhexadec-4-ynoate Openeye Name: methyl 2-benzyloxyhexadec-4-ynoate CAS Name: 2-phenylmethoxy-4-hexadecynoic acid methyl ester IUPAC Name: methyl 2-phenylmethoxyhexadec-4-ynoate Traditional Name: 2-benzoxyhexadec-4-ynoic acid methyl ester Formula: C24H36O3 MolecularWeight: 372.54084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC#CCC(C(=O)OC)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCC#CCC(C(=O)OC)OCC1=CC=CC=C1

InChI

InChI=1S/C24H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-23(24(25)26-2)27-21-22-18-15-14-16-19-22/h14-16,18-19,23H,3-12,20-21H2,1-2H3