[(1S)-1-(2-chlorophenyl)-2-(pyridin-4-ylcarbonylamino)ethyl]-diethyl-azanium

Systemtic Name: [(1S)-1-(2-chlorophenyl)-2-(pyridin-4-ylcarbonylamino)ethyl]-diethyl-azanium Openeye Name: [(1S)-1-(2-chlorophenyl)-2-(pyridine-4-carbonylamino)ethyl]-diethyl-ammonium CAS Name: [(1S)-1-(2-chlorophenyl)-2-[[oxo(pyridin-4-yl)methyl]amino]ethyl]-diethylammonium IUPAC Name: [(1S)-1-(2-chlorophenyl)-2-(pyridine-4-carbonylamino)ethyl]-diethylazanium Traditional Name: [(1S)-1-(2-chlorophenyl)-2-isonicotinamido-ethyl]-diethyl-ammonium Formula: C18H23ClN3O+ MolecularWeight: 332.84772

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)C1=CC=NC=C1)C2=CC=CC=C2Cl

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=O)C1=CC=NC=C1)C2=CC=CC=C2Cl

InChI

InChI=1S/C18H22ClN3O/c1-3-22(4-2)17(15-7-5-6-8-16(15)19)13-21-18(23)14-9-11-20-12-10-14/h5-12,17H,3-4,13H2,1-2H3,(H,21,23)/p+1/t17-/m1/s1