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

Systemtic Name: 2-methyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-6-morpholin-4-yl-1H-quinolin-4-one Openeye Name: 2-methyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-6-morpholino-1H-quinolin-4-one CAS Name: 2-methyl-3-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]-6-(4-morpholinyl)-1H-quinolin-4-one IUPAC Name: 2-methyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-6-morpholin-4-yl-1H-quinolin-4-one Traditional Name: 2-methyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-6-morpholino-4-quinolone Formula: C21H30N3O2+ MolecularWeight: 356.4818

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=C(NC3=C(C2=O)C=C(C=C3)N4CCOCC4)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC2=C(NC3=C(C2=O)C=C(C=C3)N4CCOCC4)C

InChI

InChI=1S/C21H29N3O2/c1-15-5-3-4-8-24(15)14-19-16(2)22-20-7-6-17(13-18(20)21(19)25)23-9-11-26-12-10-23/h6-7,13,15H,3-5,8-12,14H2,1-2H3,(H,22,25)/p+1/t15-/m0/s1