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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(dibutylamino)-2-oxidanylidene-ethyl]-2-propan-2-yl-pyrrolidine-3-carboxylic acid Openeye Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(dibutylamino)-2-oxo-ethyl]-2-isopropyl-pyrrolidine-3-carboxylic acid CAS Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(dibutylamino)-2-oxoethyl]-2-propan-2-yl-3-pyrrolidinecarboxylic acid IUPAC Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(dibutylamino)-2-oxoethyl]-2-propan-2-ylpyrrolidine-3-carboxylic acid Traditional Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(dibutylamino)-2-keto-ethyl]-2-isopropyl-pyrrolidine-3-carboxylic acid Formula: C25H38N2O5 MolecularWeight: 446.57962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)CN1CCC(C1(C2=CC3=C(C=C2)OCO3)C(C)C)C(=O)O

Isomeric SMILES

CCCCN(CCCC)C(=O)CN1CCC(C1(C2=CC3=C(C=C2)OCO3)C(C)C)C(=O)O

InChI

InChI=1S/C25H38N2O5/c1-5-7-12-26(13-8-6-2)23(28)16-27-14-11-20(24(29)30)25(27,18(3)4)19-9-10-21-22(15-19)32-17-31-21/h9-10,15,18,20H,5-8,11-14,16-17H2,1-4H3,(H,29,30)