diethyl-[2-[[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]amino]ethyl]azanium

Systemtic Name: diethyl-[2-[[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]amino]ethyl]azanium Openeye Name: 2-[[(3S)-1-benzylpyrrolidin-1-ium-3-yl]amino]ethyl-diethyl-ammonium CAS Name: diethyl-[2-[[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]amino]ethyl]ammonium IUPAC Name: 2-[[(3S)-1-benzylpyrrolidin-1-ium-3-yl]amino]ethyl-diethylazanium Traditional Name: 2-[[(3S)-1-benzylpyrrolidin-1-ium-3-yl]amino]ethyl-diethyl-ammonium Formula: C17H31N3+2 MolecularWeight: 277.44814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC1CC[NH+](C1)CC2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)CCN[C@H]1CC[NH+](C1)CC2=CC=CC=C2

InChI

InChI=1S/C17H29N3/c1-3-19(4-2)13-11-18-17-10-12-20(15-17)14-16-8-6-5-7-9-16/h5-9,17-18H,3-4,10-15H2,1-2H3/p+2/t17-/m0/s1