4-[(1S)-1-(2-pyrrolidin-1-ium-1-ylethylamino)ethyl]benzenecarbonitrile

Systemtic Name: 4-[(1S)-1-(2-pyrrolidin-1-ium-1-ylethylamino)ethyl]benzenecarbonitrile Openeye Name: 4-[(1S)-1-(2-pyrrolidin-1-ium-1-ylethylamino)ethyl]benzonitrile CAS Name: 4-[(1S)-1-[2-(1-pyrrolidin-1-iumyl)ethylamino]ethyl]benzonitrile IUPAC Name: 4-[(1S)-1-(2-pyrrolidin-1-ium-1-ylethylamino)ethyl]benzonitrile Traditional Name: 4-[(1S)-1-(2-pyrrolidin-1-ium-1-ylethylamino)ethyl]benzonitrile Formula: C15H22N3+ MolecularWeight: 244.35528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C#N)NCC[NH+]2CCCC2

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)C#N)NCC[NH+]2CCCC2

InChI

InChI=1S/C15H21N3/c1-13(15-6-4-14(12-16)5-7-15)17-8-11-18-9-2-3-10-18/h4-7,13,17H,2-3,8-11H2,1H3/p+1/t13-/m0/s1