(Z)-2-(6-bromanylquinolin-4-yl)ethylidene-(6-methylpyridin-2-yl)-(2-oxidanylidenepyrrolidin-1-yl)azanium

Systemtic Name: (Z)-2-(6-bromanylquinolin-4-yl)ethylidene-(6-methylpyridin-2-yl)-(2-oxidanylidenepyrrolidin-1-yl)azanium Openeye Name: (Z)-2-(6-bromo-4-quinolyl)ethylidene-(6-methyl-2-pyridyl)-(2-oxopyrrolidin-1-yl)ammonium CAS Name: (Z)-2-(6-bromo-4-quinolinyl)ethylidene-(6-methyl-2-pyridinyl)-(2-oxo-1-pyrrolidinyl)ammonium IUPAC Name: (Z)-2-(6-bromoquinolin-4-yl)ethylidene-(6-methylpyridin-2-yl)-(2-oxopyrrolidin-1-yl)azanium Traditional Name: (Z)-2-(6-bromo-4-quinolyl)ethylidene-(2-ketopyrrolidino)-(6-methyl-2-pyridyl)ammonium Formula: C21H20BrN4O+ MolecularWeight: 424.3137

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)[N+](=CCC2=C3C=C(C=CC3=NC=C2)Br)N4CCCC4=O

Isomeric SMILES

CC1=NC(=CC=C1)/[N+](=C/CC2=C3C=C(C=CC3=NC=C2)Br)/N4CCCC4=O

InChI

InChI=1S/C21H20BrN4O/c1-15-4-2-5-20(24-15)25(26-12-3-6-21(26)27)13-10-16-9-11-23-19-8-7-17(22)14-18(16)19/h2,4-5,7-9,11,13-14H,3,6,10,12H2,1H3/q+1/b25-13-