methyl (E)-5-methyl-5-oxidanyl-hept-2-enoate

Systemtic Name: methyl (E)-5-methyl-5-oxidanyl-hept-2-enoate Openeye Name: methyl (E)-5-hydroxy-5-methyl-hept-2-enoate CAS Name: (E)-5-hydroxy-5-methyl-2-heptenoic acid methyl ester IUPAC Name: methyl (E)-5-hydroxy-5-methylhept-2-enoate Traditional Name: (E)-5-hydroxy-5-methyl-hept-2-enoic acid methyl ester Formula: C9H16O3 MolecularWeight: 172.22154

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC=CC(=O)OC)O

Isomeric SMILES

CCC(C)(C/C=C/C(=O)OC)O

InChI

InChI=1S/C9H16O3/c1-4-9(2,11)7-5-6-8(10)12-3/h5-6,11H,4,7H2,1-3H3/b6-5+