methyl 7-oxidanyl-7-phenyl-hept-2-ynoate

Systemtic Name: methyl 7-oxidanyl-7-phenyl-hept-2-ynoate Openeye Name: methyl 7-hydroxy-7-phenyl-hept-2-ynoate CAS Name: 7-hydroxy-7-phenyl-2-heptynoic acid methyl ester IUPAC Name: methyl 7-hydroxy-7-phenylhept-2-ynoate Traditional Name: 7-hydroxy-7-phenyl-hept-2-ynoic acid methyl ester Formula: C14H16O3 MolecularWeight: 232.27504

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C#CCCCC(C1=CC=CC=C1)O

Isomeric SMILES

COC(=O)C#CCCCC(C1=CC=CC=C1)O

InChI

InChI=1S/C14H16O3/c1-17-14(16)11-7-3-6-10-13(15)12-8-4-2-5-9-12/h2,4-5,8-9,13,15H,3,6,10H2,1H3