1-[1-(1,3-benzodioxol-5-yl)-2-pyridin-2-yl-ethyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[1-(1,3-benzodioxol-5-yl)-2-pyridin-2-yl-ethyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[1-(1,3-benzodioxol-5-yl)-2-(2-pyridyl)ethyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[1-(1,3-benzodioxol-5-yl)-2-(2-pyridinyl)ethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[1-(1,3-benzodioxol-5-yl)-2-pyridin-2-ylethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[1-(1,3-benzodioxol-5-yl)-2-(2-pyridyl)ethyl]proline Formula: C19H20N2O4 MolecularWeight: 340.3731

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(CC2=CC=CC=N2)C3=CC4=C(C=C3)OCO4)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(CC2=CC=CC=N2)C3=CC4=C(C=C3)OCO4)C(=O)O

InChI

InChI=1S/C19H20N2O4/c22-19(23)15-5-3-9-21(15)16(11-14-4-1-2-8-20-14)13-6-7-17-18(10-13)25-12-24-17/h1-2,4,6-8,10,15-16H,3,5,9,11-12H2,(H,22,23)