4-(5-ethyl-2-methoxy-phenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(5-ethyl-2-methoxy-phenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(5-ethyl-2-methoxy-phenyl)-4-oxo-butanoic acid CAS Name: 4-(5-ethyl-2-methoxyphenyl)-4-oxobutanoic acid IUPAC Name: 4-(5-ethyl-2-methoxyphenyl)-4-oxobutanoic acid Traditional Name: 4-(5-ethyl-2-methoxy-phenyl)-4-keto-butyric acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OC)C(=O)CCC(=O)O

Isomeric SMILES

CCC1=CC(=C(C=C1)OC)C(=O)CCC(=O)O

InChI

InChI=1S/C13H16O4/c1-3-9-4-6-12(17-2)10(8-9)11(14)5-7-13(15)16/h4,6,8H,3,5,7H2,1-2H3,(H,15,16)