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2-[(3-methoxy-4-oxidanyl-phenyl)methyl]butanoic acid

2-[(3-methoxy-4-oxidanyl-phenyl)methyl]butanoic acid

Systemtic Name:2-[(3-methoxy-4-oxidanyl-phenyl)methyl]butanoic acid
Openeye Name:2-[(4-hydroxy-3-methoxy-phenyl)methyl]butanoic acid
CAS Name:2-[(4-hydroxy-3-methoxyphenyl)methyl]butanoic acid
IUPAC Name:2-[(4-hydroxy-3-methoxyphenyl)methyl]butanoic acid
Traditional Name:2-vanillylbutyric acid
Formula: C12H16O4
MolecularWeight: 224.25304
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C12H16O4/c1-3-9(12(14)15)6-8-4-5-10(13)11(7-8)16-2/h4-5,7,9,13H,3,6H2,1-2H3,(H,14,15)


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