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

Systemtic Name: 7-(5-methoxy-2-oxidanyl-phenyl)-5-methyl-7-oxidanyl-hept-2-ynoate Openeye Name: 7-hydroxy-7-(2-hydroxy-5-methoxy-phenyl)-5-methyl-hept-2-ynoate CAS Name: 7-hydroxy-7-(2-hydroxy-5-methoxyphenyl)-5-methyl-2-heptynoate IUPAC Name: 7-hydroxy-7-(2-hydroxy-5-methoxyphenyl)-5-methylhept-2-ynoate Traditional Name: 7-hydroxy-7-(2-hydroxy-5-methoxy-phenyl)-5-methyl-hept-2-ynoate Formula: C15H17O5- MolecularWeight: 277.29248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18O5/c1-10(4-3-5-15(18)19)8-14(17)12-9-11(20-2)6-7-13(12)16/h6-7,9-10,14,16-17H,4,8H2,1-2H3,(H,18,19)/p-1