2-[3-[(1R)-2-azaniumyl-1-pyrrolidin-1-ium-1-yl-ethyl]phenoxy]ethyl-diethyl-azanium

Systemtic Name: 2-[3-[(1R)-2-azaniumyl-1-pyrrolidin-1-ium-1-yl-ethyl]phenoxy]ethyl-diethyl-azanium Openeye Name: 2-[3-[(1R)-2-azaniumyl-1-pyrrolidin-1-ium-1-yl-ethyl]phenoxy]ethyl-diethyl-ammonium CAS Name: 2-[3-[(1R)-2-ammonio-1-(1-pyrrolidin-1-iumyl)ethyl]phenoxy]ethyl-diethylammonium IUPAC Name: 2-[3-[(1R)-2-azaniumyl-1-pyrrolidin-1-ium-1-ylethyl]phenoxy]ethyl-diethylazanium Traditional Name: 2-[3-[(1R)-2-ammonio-1-pyrrolidin-1-ium-1-yl-ethyl]phenoxy]ethyl-diethyl-ammonium Formula: C18H34N3O+3 MolecularWeight: 308.48206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=CC=CC(=C1)C(C[NH3+])[NH+]2CCCC2

Isomeric SMILES

CC[NH+](CC)CCOC1=CC=CC(=C1)[C@H](C[NH3+])[NH+]2CCCC2

InChI

InChI=1S/C18H31N3O/c1-3-20(4-2)12-13-22-17-9-7-8-16(14-17)18(15-19)21-10-5-6-11-21/h7-9,14,18H,3-6,10-13,15,19H2,1-2H3/p+3/t18-/m0/s1