N-[[3-(diphenylmethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-ethyl-2-pyrrolidin-1-ium-1-yl-ethanamine

Systemtic Name: N-[[3-(diphenylmethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-ethyl-2-pyrrolidin-1-ium-1-yl-ethanamine Openeye Name: N-[(3-benzhydryl-1,2,4-oxadiazol-5-yl)methyl]-N-ethyl-2-pyrrolidin-1-ium-1-yl-ethanamine CAS Name: N-[[3-(diphenylmethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-ethyl-2-(1-pyrrolidin-1-iumyl)ethanamine IUPAC Name: N-[(3-benzhydryl-1,2,4-oxadiazol-5-yl)methyl]-N-ethyl-2-pyrrolidin-1-ium-1-ylethanamine Traditional Name: (3-benzhydryl-1,2,4-oxadiazol-5-yl)methyl-ethyl-(2-pyrrolidin-1-ium-1-ylethyl)amine Formula: C24H31N4O+ MolecularWeight: 391.52914

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC[NH+]1CCCC1)CC2=NC(=NO2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCN(CC[NH+]1CCCC1)CC2=NC(=NO2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H30N4O/c1-2-27(17-18-28-15-9-10-16-28)19-22-25-24(26-29-22)23(20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-8,11-14,23H,2,9-10,15-19H2,1H3/p+1