(2S)-3-(3-chloranyl-5-ethoxy-4-methoxy-phenyl)-2-(3,4-dimethoxyphenyl)propanoic acid

Systemtic Name: (2S)-3-(3-chloranyl-5-ethoxy-4-methoxy-phenyl)-2-(3,4-dimethoxyphenyl)propanoic acid Openeye Name: (2S)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)-2-(3,4-dimethoxyphenyl)propanoic acid CAS Name: (2S)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)propanoic acid IUPAC Name: (2S)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)-2-(3,4-dimethoxyphenyl)propanoic acid Traditional Name: (2S)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)-2-(3,4-dimethoxyphenyl)propionic acid Formula: C20H23ClO6 MolecularWeight: 394.84602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CC(C2=CC(=C(C=C2)OC)OC)C(=O)O)Cl)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[C@@H](C2=CC(=C(C=C2)OC)OC)C(=O)O)Cl)OC

InChI

InChI=1S/C20H23ClO6/c1-5-27-18-10-12(9-15(21)19(18)26-4)8-14(20(22)23)13-6-7-16(24-2)17(11-13)25-3/h6-7,9-11,14H,5,8H2,1-4H3,(H,22,23)/t14-/m0/s1