5-(2-methanoyl-4-methoxy-3-oxidanyl-phenoxy)pentanoic acid

Systemtic Name: 5-(2-methanoyl-4-methoxy-3-oxidanyl-phenoxy)pentanoic acid Openeye Name: 5-(2-formyl-3-hydroxy-4-methoxy-phenoxy)pentanoic acid CAS Name: 5-(2-formyl-3-hydroxy-4-methoxyphenoxy)pentanoic acid IUPAC Name: 5-(2-formyl-3-hydroxy-4-methoxyphenoxy)pentanoic acid Traditional Name: 5-(2-formyl-3-hydroxy-4-methoxy-phenoxy)valeric acid Formula: C13H16O6 MolecularWeight: 268.26254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)OCCCCC(=O)O)C=O)O

Isomeric SMILES

COC1=C(C(=C(C=C1)OCCCCC(=O)O)C=O)O

InChI

InChI=1S/C13H16O6/c1-18-11-6-5-10(9(8-14)13(11)17)19-7-3-2-4-12(15)16/h5-6,8,17H,2-4,7H2,1H3,(H,15,16)