(3R)-N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3R)-N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3R)-N-[1-(2-amino-2-oxo-ethyl)piperidin-1-ium-4-yl]-1-(1,3-benzodioxol-5-yl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3R)-N-[1-(2-amino-2-oxoethyl)-4-piperidin-1-iumyl]-1-(1,3-benzodioxol-5-yl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3R)-N-[1-(2-amino-2-oxoethyl)piperidin-1-ium-4-yl]-1-(1,3-benzodioxol-5-yl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3R)-N-[1-(2-amino-2-keto-ethyl)piperidin-1-ium-4-yl]-1-(1,3-benzodioxol-5-yl)-5-keto-pyrrolidine-3-carboxamide Formula: C19H25N4O5+ MolecularWeight: 389.4256

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2CC(=O)N(C2)C3=CC4=C(C=C3)OCO4)CC(=O)N

Isomeric SMILES

C1C[NH+](CCC1NC(=O)[C@@H]2CC(=O)N(C2)C3=CC4=C(C=C3)OCO4)CC(=O)N

InChI

InChI=1S/C19H24N4O5/c20-17(24)10-22-5-3-13(4-6-22)21-19(26)12-7-18(25)23(9-12)14-1-2-15-16(8-14)28-11-27-15/h1-2,8,12-13H,3-7,9-11H2,(H2,20,24)(H,21,26)/p+1/t12-/m1/s1