2-methyl-3-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1H-quinolin-4-one

Systemtic Name: 2-methyl-3-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1H-quinolin-4-one Openeye Name: 2-methyl-3-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1H-quinolin-4-one CAS Name: 2-methyl-3-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-1H-quinolin-4-one IUPAC Name: 2-methyl-3-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1H-quinolin-4-one Traditional Name: 2-methyl-3-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-4-quinolone Formula: C17H23N2O+ MolecularWeight: 271.37732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=C(NC3=CC=CC=C3C2=O)C

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC2=C(NC3=CC=CC=C3C2=O)C

InChI

InChI=1S/C17H22N2O/c1-12-6-5-9-19(10-12)11-15-13(2)18-16-8-4-3-7-14(16)17(15)20/h3-4,7-8,12H,5-6,9-11H2,1-2H3,(H,18,20)/p+1/t12-/m0/s1