2-[[(1S)-1-(4-cyanophenyl)ethyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(1S)-1-(4-cyanophenyl)ethyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[(1S)-1-(4-cyanophenyl)ethyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(1S)-1-(4-cyanophenyl)ethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(1S)-1-(4-cyanophenyl)ethyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[(1S)-1-(4-cyanophenyl)ethyl]amino]ethyl-dimethyl-ammonium Formula: C13H20N3+ MolecularWeight: 218.318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C#N)NCC[NH+](C)C

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)C#N)NCC[NH+](C)C

InChI

InChI=1S/C13H19N3/c1-11(15-8-9-16(2)3)13-6-4-12(10-14)5-7-13/h4-7,11,15H,8-9H2,1-3H3/p+1/t11-/m0/s1