2-[4-(diethylamino)-3-ethoxy-phenyl]-2-(4-pyrrolidin-1-ylphenyl)propanoic acid

Systemtic Name: 2-[4-(diethylamino)-3-ethoxy-phenyl]-2-(4-pyrrolidin-1-ylphenyl)propanoic acid Openeye Name: 2-[4-(diethylamino)-3-ethoxy-phenyl]-2-(4-pyrrolidin-1-ylphenyl)propanoic acid CAS Name: 2-[4-(diethylamino)-3-ethoxyphenyl]-2-[4-(1-pyrrolidinyl)phenyl]propanoic acid IUPAC Name: 2-[4-(diethylamino)-3-ethoxyphenyl]-2-(4-pyrrolidin-1-ylphenyl)propanoic acid Traditional Name: 2-[4-(diethylamino)-3-ethoxy-phenyl]-2-(4-pyrrolidinophenyl)propionic acid Formula: C25H34N2O3 MolecularWeight: 410.54906

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)C(C)(C2=CC=C(C=C2)N3CCCC3)C(=O)O)OCC

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)C(C)(C2=CC=C(C=C2)N3CCCC3)C(=O)O)OCC

InChI

InChI=1S/C25H34N2O3/c1-5-26(6-2)22-15-12-20(18-23(22)30-7-3)25(4,24(28)29)19-10-13-21(14-11-19)27-16-8-9-17-27/h10-15,18H,5-9,16-17H2,1-4H3,(H,28,29)