2-butoxy-3-(2-methyl-4-phenylmethoxy-phenyl)-3-oxidanyl-propanoic acid

Systemtic Name: 2-butoxy-3-(2-methyl-4-phenylmethoxy-phenyl)-3-oxidanyl-propanoic acid Openeye Name: 3-(4-benzyloxy-2-methyl-phenyl)-2-butoxy-3-hydroxy-propanoic acid CAS Name: 2-butoxy-3-hydroxy-3-(2-methyl-4-phenylmethoxyphenyl)propanoic acid IUPAC Name: 2-butoxy-3-hydroxy-3-(2-methyl-4-phenylmethoxyphenyl)propanoic acid Traditional Name: 3-(4-benzoxy-2-methyl-phenyl)-2-butoxy-3-hydroxy-propionic acid Formula: C21H26O5 MolecularWeight: 358.42814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C(C1=C(C=C(C=C1)OCC2=CC=CC=C2)C)O)C(=O)O

Isomeric SMILES

CCCCOC(C(C1=C(C=C(C=C1)OCC2=CC=CC=C2)C)O)C(=O)O

InChI

InChI=1S/C21H26O5/c1-3-4-12-25-20(21(23)24)19(22)18-11-10-17(13-15(18)2)26-14-16-8-6-5-7-9-16/h5-11,13,19-20,22H,3-4,12,14H2,1-2H3,(H,23,24)