1,2,5-oxadiazol-3-yl-[(3R)-3-(1-phenethylpiperidin-1-ium-4-yl)pyrrolidin-1-yl]methanone

Systemtic Name: 1,2,5-oxadiazol-3-yl-[(3R)-3-(1-phenethylpiperidin-1-ium-4-yl)pyrrolidin-1-yl]methanone Openeye Name: 1,2,5-oxadiazol-3-yl-[(3R)-3-(1-phenethylpiperidin-1-ium-4-yl)pyrrolidin-1-yl]methanone CAS Name: 1,2,5-oxadiazol-3-yl-[(3R)-3-(1-phenethyl-4-piperidin-1-iumyl)-1-pyrrolidinyl]methanone IUPAC Name: 1,2,5-oxadiazol-3-yl-[(3R)-3-(1-phenethylpiperidin-1-ium-4-yl)pyrrolidin-1-yl]methanone Traditional Name: furazan-3-yl-[(3R)-3-(1-phenethylpiperidin-1-ium-4-yl)pyrrolidino]methanone Formula: C20H27N4O2+ MolecularWeight: 355.45398

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2CCN(C2)C(=O)C3=NON=C3)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(C[C@H]1C2CC[NH+](CC2)CCC3=CC=CC=C3)C(=O)C4=NON=C4

InChI

InChI=1S/C20H26N4O2/c25-20(19-14-21-26-22-19)24-13-9-18(15-24)17-7-11-23(12-8-17)10-6-16-4-2-1-3-5-16/h1-5,14,17-18H,6-13,15H2/p+1/t18-/m0/s1