methyl 2-phenoxyhexadec-4-ynoate

Systemtic Name: methyl 2-phenoxyhexadec-4-ynoate Openeye Name: methyl 2-phenoxyhexadec-4-ynoate CAS Name: 2-phenoxy-4-hexadecynoic acid methyl ester IUPAC Name: methyl 2-phenoxyhexadec-4-ynoate Traditional Name: 2-phenoxyhexadec-4-ynoic acid methyl ester Formula: C23H34O3 MolecularWeight: 358.51426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC#CCC(C(=O)OC)OC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCC#CCC(C(=O)OC)OC1=CC=CC=C1

InChI

InChI=1S/C23H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-22(23(24)25-2)26-21-18-15-14-16-19-21/h14-16,18-19,22H,3-12,20H2,1-2H3