methyl (E,4S,5S)-4-(2-methyl-4-oxidanyl-phenyl)-5-oxidanyl-hex-2-enoate

Systemtic Name: methyl (E,4S,5S)-4-(2-methyl-4-oxidanyl-phenyl)-5-oxidanyl-hex-2-enoate Openeye Name: methyl (E,4S,5S)-5-hydroxy-4-(4-hydroxy-2-methyl-phenyl)hex-2-enoate CAS Name: (E,4S,5S)-5-hydroxy-4-(4-hydroxy-2-methylphenyl)-2-hexenoic acid methyl ester IUPAC Name: methyl (E,4S,5S)-5-hydroxy-4-(4-hydroxy-2-methylphenyl)hex-2-enoate Traditional Name: (E,4S,5S)-5-hydroxy-4-(4-hydroxy-2-methyl-phenyl)hex-2-enoic acid methyl ester Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)O)C(C=CC(=O)OC)C(C)O

Isomeric SMILES

CC1=C(C=CC(=C1)O)[C@H](/C=C/C(=O)OC)[C@H](C)O

InChI

InChI=1S/C14H18O4/c1-9-8-11(16)4-5-12(9)13(10(2)15)6-7-14(17)18-3/h4-8,10,13,15-16H,1-3H3/b7-6+/t10-,13+/m0/s1