methyl 7-phenylhept-5-ynoate

Systemtic Name: methyl 7-phenylhept-5-ynoate Openeye Name: methyl 7-phenylhept-5-ynoate CAS Name: 7-phenyl-5-heptynoic acid methyl ester IUPAC Name: methyl 7-phenylhept-5-ynoate Traditional Name: 7-phenylhept-5-ynoic acid methyl ester Formula: C14H16O2 MolecularWeight: 216.27564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC#CCC1=CC=CC=C1

Isomeric SMILES

COC(=O)CCCC#CCC1=CC=CC=C1

InChI

InChI=1S/C14H16O2/c1-16-14(15)12-8-3-2-5-9-13-10-6-4-7-11-13/h4,6-7,10-11H,3,8-9,12H2,1H3