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

Systemtic Name: 6-methyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-2-phenyl-1H-quinolin-4-one Openeye Name: 6-methyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-2-phenyl-1H-quinolin-4-one CAS Name: 6-methyl-3-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]-2-phenyl-1H-quinolin-4-one IUPAC Name: 6-methyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-2-phenyl-1H-quinolin-4-one Traditional Name: 6-methyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-2-phenyl-4-quinolone Formula: C23H27N2O+ MolecularWeight: 347.47328

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=C(NC3=C(C2=O)C=C(C=C3)C)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC2=C(NC3=C(C2=O)C=C(C=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C23H26N2O/c1-16-11-12-21-19(14-16)23(26)20(15-25-13-7-6-8-17(25)2)22(24-21)18-9-4-3-5-10-18/h3-5,9-12,14,17H,6-8,13,15H2,1-2H3,(H,24,26)/p+1/t17-/m0/s1