(2S)-3-[4-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]-2-(4-methoxyphenyl)propanoic acid

Systemtic Name: (2S)-3-[4-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]-2-(4-methoxyphenyl)propanoic acid Openeye Name: (2S)-3-[4-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]-2-(4-methoxyphenyl)propanoic acid CAS Name: (2S)-3-[4-(2-dimethylaminoethyloxy)-3-methoxyphenyl]-2-(4-methoxyphenyl)propanoic acid IUPAC Name: (2S)-3-[4-(2-dimethylaminoethyloxy)-3-methoxyphenyl]-2-(4-methoxyphenyl)propanoic acid Traditional Name: (2S)-3-[4-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]-2-(4-methoxyphenyl)propionic acid Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO5/c1-22(2)11-12-27-19-10-5-15(14-20(19)26-4)13-18(21(23)24)16-6-8-17(25-3)9-7-16/h5-10,14,18H,11-13H2,1-4H3,(H,23,24)/t18-/m0/s1