(2S)-2-(3,4-dimethoxyphenyl)-3-(3-hexoxyphenyl)propanoate

Systemtic Name: (2S)-2-(3,4-dimethoxyphenyl)-3-(3-hexoxyphenyl)propanoate Openeye Name: (2S)-2-(3,4-dimethoxyphenyl)-3-(3-hexoxyphenyl)propanoate CAS Name: (2S)-2-(3,4-dimethoxyphenyl)-3-(3-hexoxyphenyl)propanoate IUPAC Name: (2S)-2-(3,4-dimethoxyphenyl)-3-(3-hexoxyphenyl)propanoate Traditional Name: (2S)-2-(3,4-dimethoxyphenyl)-3-(3-hexoxyphenyl)propionate Formula: C23H29O5- MolecularWeight: 385.47336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC(=C1)CC(C2=CC(=C(C=C2)OC)OC)C(=O)[O-]

Isomeric SMILES

CCCCCCOC1=CC=CC(=C1)C[C@@H](C2=CC(=C(C=C2)OC)OC)C(=O)[O-]

InChI

InChI=1S/C23H30O5/c1-4-5-6-7-13-28-19-10-8-9-17(14-19)15-20(23(24)25)18-11-12-21(26-2)22(16-18)27-3/h8-12,14,16,20H,4-7,13,15H2,1-3H3,(H,24,25)/p-1/t20-/m0/s1