(2S,4R)-N-ethyl-4-[(1-ethylpiperidin-1-ium-4-yl)amino]-1-(naphthalen-2-ylmethyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S,4R)-N-ethyl-4-[(1-ethylpiperidin-1-ium-4-yl)amino]-1-(naphthalen-2-ylmethyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S,4R)-N-ethyl-4-[(1-ethylpiperidin-1-ium-4-yl)amino]-1-(2-naphthylmethyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2S,4R)-N-ethyl-4-[(1-ethyl-4-piperidin-1-iumyl)amino]-1-(2-naphthalenylmethyl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S,4R)-N-ethyl-4-[(1-ethylpiperidin-1-ium-4-yl)amino]-1-(naphthalen-2-ylmethyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S,4R)-N-ethyl-4-[(1-ethylpiperidin-1-ium-4-yl)amino]-1-(2-naphthylmethyl)pyrrolidin-1-ium-2-carboxamide Formula: C25H38N4O+2 MolecularWeight: 410.59542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1CC(C[NH+]1CC2=CC3=CC=CC=C3C=C2)NC4CC[NH+](CC4)CC

Isomeric SMILES

CCNC(=O)[C@@H]1C[C@H](C[NH+]1CC2=CC3=CC=CC=C3C=C2)NC4CC[NH+](CC4)CC

InChI

InChI=1S/C25H36N4O/c1-3-26-25(30)24-16-23(27-22-11-13-28(4-2)14-12-22)18-29(24)17-19-9-10-20-7-5-6-8-21(20)15-19/h5-10,15,22-24,27H,3-4,11-14,16-18H2,1-2H3,(H,26,30)/p+2/t23-,24+/m1/s1