N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-N-(1,3-thiazol-2-ylmethyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-N-(1,3-thiazol-2-ylmethyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-N-(thiazol-2-ylmethyl)-1,3-benzodioxole-5-carboxamide CAS Name: N-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-N-(2-thiazolylmethyl)-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-N-(1,3-thiazol-2-ylmethyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-N-(thiazol-2-ylmethyl)-piperonylamide Formula: C19H24N3O3S+ MolecularWeight: 374.47716

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CN(CC2=NC=CS2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC[NH+]1CCC[C@@H]1CN(CC2=NC=CS2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H23N3O3S/c1-2-21-8-3-4-15(21)11-22(12-18-20-7-9-26-18)19(23)14-5-6-16-17(10-14)25-13-24-16/h5-7,9-10,15H,2-4,8,11-13H2,1H3/p+1/t15-/m1/s1