[(3S)-5-oxidanylidene-1-phenethyl-pyrrolidin-3-yl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: [(3S)-5-oxidanylidene-1-phenethyl-pyrrolidin-3-yl]-(pyridin-4-ylmethyl)azanium Openeye Name: [(3S)-5-oxo-1-phenethyl-pyrrolidin-3-yl]-(4-pyridylmethyl)ammonium CAS Name: [(3S)-5-oxo-1-phenethyl-3-pyrrolidinyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: [(3S)-5-oxo-1-phenethylpyrrolidin-3-yl]-(pyridin-4-ylmethyl)azanium Traditional Name: [(3S)-5-keto-1-phenethyl-pyrrolidin-3-yl]-(4-pyridylmethyl)ammonium Formula: C18H22N3O+ MolecularWeight: 296.38678

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CCC2=CC=CC=C2)[NH2+]CC3=CC=NC=C3

Isomeric SMILES

C1[C@@H](CN(C1=O)CCC2=CC=CC=C2)[NH2+]CC3=CC=NC=C3

InChI

InChI=1S/C18H21N3O/c22-18-12-17(20-13-16-6-9-19-10-7-16)14-21(18)11-8-15-4-2-1-3-5-15/h1-7,9-10,17,20H,8,11-14H2/p+1/t17-/m0/s1