(2S)-3-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-2-phenyl-propanoic acid

Systemtic Name: (2S)-3-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-2-phenyl-propanoic acid Openeye Name: (2S)-3-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-2-phenyl-propanoic acid CAS Name: (2S)-3-[3-methoxy-4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-2-phenylpropanoic acid IUPAC Name: (2S)-3-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-2-phenylpropanoic acid Traditional Name: (2S)-3-[3-methoxy-4-(2-pyrrolidinoethoxy)phenyl]-2-phenyl-propionic acid Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC(C2=CC=CC=C2)C(=O)O)OCCN3CCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)C[C@@H](C2=CC=CC=C2)C(=O)O)OCCN3CCCC3

InChI

InChI=1S/C22H27NO4/c1-26-21-16-17(15-19(22(24)25)18-7-3-2-4-8-18)9-10-20(21)27-14-13-23-11-5-6-12-23/h2-4,7-10,16,19H,5-6,11-15H2,1H3,(H,24,25)/t19-/m0/s1