(E,5S)-5-(4-methoxy-3-oxidanyl-phenyl)-4,4-dimethyl-5-oxidanyl-pent-2-enoic acid

Systemtic Name: (E,5S)-5-(4-methoxy-3-oxidanyl-phenyl)-4,4-dimethyl-5-oxidanyl-pent-2-enoic acid Openeye Name: (E,5S)-5-hydroxy-5-(3-hydroxy-4-methoxy-phenyl)-4,4-dimethyl-pent-2-enoic acid CAS Name: (E,5S)-5-hydroxy-5-(3-hydroxy-4-methoxyphenyl)-4,4-dimethyl-2-pentenoic acid IUPAC Name: (E,5S)-5-hydroxy-5-(3-hydroxy-4-methoxyphenyl)-4,4-dimethylpent-2-enoic acid Traditional Name: (E,5S)-5-hydroxy-5-(3-hydroxy-4-methoxy-phenyl)-4,4-dimethyl-pent-2-enoic acid Formula: C14H18O5 MolecularWeight: 266.28972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O5/c1-14(2,7-6-12(16)17)13(18)9-4-5-11(19-3)10(15)8-9/h4-8,13,15,18H,1-3H3,(H,16,17)/b7-6+/t13-/m1/s1