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

Systemtic Name: 3-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methyl-6-morpholin-4-yl-1H-quinolin-4-one Openeye Name: 3-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methyl-6-morpholino-1H-quinolin-4-one CAS Name: 3-[[(2S)-2-ethyl-1-piperidin-1-iumyl]methyl]-2-methyl-6-(4-morpholinyl)-1H-quinolin-4-one IUPAC Name: 3-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methyl-6-morpholin-4-yl-1H-quinolin-4-one Traditional Name: 3-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methyl-6-morpholino-4-quinolone Formula: C22H32N3O2+ MolecularWeight: 370.50838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC2=C(NC3=C(C2=O)C=C(C=C3)N4CCOCC4)C

Isomeric SMILES

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

InChI

InChI=1S/C22H31N3O2/c1-3-17-6-4-5-9-25(17)15-20-16(2)23-21-8-7-18(14-19(21)22(20)26)24-10-12-27-13-11-24/h7-8,14,17H,3-6,9-13,15H2,1-2H3,(H,23,26)/p+1/t17-/m0/s1