3-[1-[(phenylmethyl)amino]pyrrolidin-1-ium-1-yl]propanenitrile

Systemtic Name: 3-[1-[(phenylmethyl)amino]pyrrolidin-1-ium-1-yl]propanenitrile Openeye Name: 3-[1-(benzylamino)pyrrolidin-1-ium-1-yl]propanenitrile CAS Name: 3-[1-[(phenylmethyl)amino]-1-pyrrolidin-1-iumyl]propanenitrile IUPAC Name: 3-[1-(benzylamino)pyrrolidin-1-ium-1-yl]propanenitrile Traditional Name: 3-[1-(benzylamino)pyrrolidin-1-ium-1-yl]propionitrile Formula: C14H20N3+ MolecularWeight: 230.3287

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](C1)(CCC#N)NCC2=CC=CC=C2

Isomeric SMILES

C1CC[N+](C1)(CCC#N)NCC2=CC=CC=C2

InChI

InChI=1S/C14H20N3/c15-9-6-12-17(10-4-5-11-17)16-13-14-7-2-1-3-8-14/h1-3,7-8,16H,4-6,10-13H2/q+1