methyl (E,5S)-7-oxidanyl-5-phenyl-hept-2-enoate

Systemtic Name: methyl (E,5S)-7-oxidanyl-5-phenyl-hept-2-enoate Openeye Name: methyl (E,5S)-7-hydroxy-5-phenyl-hept-2-enoate CAS Name: (E,5S)-7-hydroxy-5-phenyl-2-heptenoic acid methyl ester IUPAC Name: methyl (E,5S)-7-hydroxy-5-phenylhept-2-enoate Traditional Name: (E,5S)-7-hydroxy-5-phenyl-hept-2-enoic acid methyl ester Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CCC(CCO)C1=CC=CC=C1

Isomeric SMILES

COC(=O)/C=C/C[C@@H](CCO)C1=CC=CC=C1

InChI

InChI=1S/C14H18O3/c1-17-14(16)9-5-8-13(10-11-15)12-6-3-2-4-7-12/h2-7,9,13,15H,8,10-11H2,1H3/b9-5+/t13-/m0/s1