ethyl 4-(1,3-benzodioxol-5-yl)-2-(2-pyridin-2-ylethyl)pyrrolidine-3-carboxylate

Systemtic Name: ethyl 4-(1,3-benzodioxol-5-yl)-2-(2-pyridin-2-ylethyl)pyrrolidine-3-carboxylate Openeye Name: ethyl 4-(1,3-benzodioxol-5-yl)-2-[2-(2-pyridyl)ethyl]pyrrolidine-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-2-[2-(2-pyridinyl)ethyl]-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzodioxol-5-yl)-2-(2-pyridin-2-ylethyl)pyrrolidine-3-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-[2-(2-pyridyl)ethyl]pyrrolidine-3-carboxylic acid ethyl ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CNC1CCC2=CC=CC=N2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)C1C(CNC1CCC2=CC=CC=N2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H24N2O4/c1-2-25-21(24)20-16(14-6-9-18-19(11-14)27-13-26-18)12-23-17(20)8-7-15-5-3-4-10-22-15/h3-6,9-11,16-17,20,23H,2,7-8,12-13H2,1H3