(2S)-3-(4-butoxy-3-methoxy-phenyl)-2-(4-methoxyphenyl)propanoate

Systemtic Name: (2S)-3-(4-butoxy-3-methoxy-phenyl)-2-(4-methoxyphenyl)propanoate Openeye Name: (2S)-3-(4-butoxy-3-methoxy-phenyl)-2-(4-methoxyphenyl)propanoate CAS Name: (2S)-3-(4-butoxy-3-methoxyphenyl)-2-(4-methoxyphenyl)propanoate IUPAC Name: (2S)-3-(4-butoxy-3-methoxyphenyl)-2-(4-methoxyphenyl)propanoate Traditional Name: (2S)-3-(4-butoxy-3-methoxy-phenyl)-2-(4-methoxyphenyl)propionate Formula: C21H25O5- MolecularWeight: 357.4202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26O5/c1-4-5-12-26-19-11-6-15(14-20(19)25-3)13-18(21(22)23)16-7-9-17(24-2)10-8-16/h6-11,14,18H,4-5,12-13H2,1-3H3,(H,22,23)/p-1/t18-/m0/s1