6-bromanyl-3-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methyl-1H-quinolin-4-one

Systemtic Name: 6-bromanyl-3-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methyl-1H-quinolin-4-one Openeye Name: 6-bromo-3-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methyl-1H-quinolin-4-one CAS Name: 6-bromo-3-[[(2R)-2-ethyl-1-piperidin-1-iumyl]methyl]-2-methyl-1H-quinolin-4-one IUPAC Name: 6-bromo-3-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methyl-1H-quinolin-4-one Traditional Name: 6-bromo-3-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methyl-4-quinolone Formula: C18H24BrN2O+ MolecularWeight: 364.29996

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC2=C(NC3=C(C2=O)C=C(C=C3)Br)C

Isomeric SMILES

CC[C@@H]1CCCC[NH+]1CC2=C(NC3=C(C2=O)C=C(C=C3)Br)C

InChI

InChI=1S/C18H23BrN2O/c1-3-14-6-4-5-9-21(14)11-16-12(2)20-17-8-7-13(19)10-15(17)18(16)22/h7-8,10,14H,3-6,9,11H2,1-2H3,(H,20,22)/p+1/t14-/m1/s1