[(1S)-1-(4-cyanophenyl)ethyl]-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)azanium

Systemtic Name: [(1S)-1-(4-cyanophenyl)ethyl]-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)azanium Openeye Name: [(1S)-1-(4-cyanophenyl)ethyl]-(3-oxo-3-pyrrolidin-1-yl-propyl)ammonium CAS Name: [(1S)-1-(4-cyanophenyl)ethyl]-[3-oxo-3-(1-pyrrolidinyl)propyl]ammonium IUPAC Name: [(1S)-1-(4-cyanophenyl)ethyl]-(3-oxo-3-pyrrolidin-1-ylpropyl)azanium Traditional Name: [(1S)-1-(4-cyanophenyl)ethyl]-(3-keto-3-pyrrolidino-propyl)ammonium Formula: C16H22N3O+ MolecularWeight: 272.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C#N)[NH2+]CCC(=O)N2CCCC2

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)C#N)[NH2+]CCC(=O)N2CCCC2

InChI

InChI=1S/C16H21N3O/c1-13(15-6-4-14(12-17)5-7-15)18-9-8-16(20)19-10-2-3-11-19/h4-7,13,18H,2-3,8-11H2,1H3/p+1/t13-/m0/s1