(2S)-3-(3-butoxy-4-methoxy-phenyl)-2-(3,4-dimethoxyphenyl)propanoic acid

Systemtic Name: (2S)-3-(3-butoxy-4-methoxy-phenyl)-2-(3,4-dimethoxyphenyl)propanoic acid Openeye Name: (2S)-3-(3-butoxy-4-methoxy-phenyl)-2-(3,4-dimethoxyphenyl)propanoic acid CAS Name: (2S)-3-(3-butoxy-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)propanoic acid IUPAC Name: (2S)-3-(3-butoxy-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)propanoic acid Traditional Name: (2S)-3-(3-butoxy-4-methoxy-phenyl)-2-(3,4-dimethoxyphenyl)propionic acid Formula: C22H28O6 MolecularWeight: 388.45412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)CC(C2=CC(=C(C=C2)OC)OC)C(=O)O)OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)C[C@@H](C2=CC(=C(C=C2)OC)OC)C(=O)O)OC

InChI

InChI=1S/C22H28O6/c1-5-6-11-28-21-13-15(7-9-19(21)26-3)12-17(22(23)24)16-8-10-18(25-2)20(14-16)27-4/h7-10,13-14,17H,5-6,11-12H2,1-4H3,(H,23,24)/t17-/m0/s1