7-(5-methoxy-2-oxidanyl-phenyl)-5-methyl-hept-2-ynoate

Systemtic Name: 7-(5-methoxy-2-oxidanyl-phenyl)-5-methyl-hept-2-ynoate Openeye Name: 7-(2-hydroxy-5-methoxy-phenyl)-5-methyl-hept-2-ynoate CAS Name: 7-(2-hydroxy-5-methoxyphenyl)-5-methyl-2-heptynoate IUPAC Name: 7-(2-hydroxy-5-methoxyphenyl)-5-methylhept-2-ynoate Traditional Name: 7-(2-hydroxy-5-methoxy-phenyl)-5-methyl-hept-2-ynoate Formula: C15H17O4- MolecularWeight: 261.29308

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=C(C=CC(=C1)OC)O)CC#CC(=O)[O-]

Isomeric SMILES

CC(CCC1=C(C=CC(=C1)OC)O)CC#CC(=O)[O-]

InChI

InChI=1S/C15H18O4/c1-11(4-3-5-15(17)18)6-7-12-10-13(19-2)8-9-14(12)16/h8-11,16H,4,6-7H2,1-2H3,(H,17,18)/p-1