methyl-(1-methylpiperidin-1-ium-4-yl)-[(2,5,7-trimethyl-4-oxidanylidene-1H-quinolin-3-yl)methyl]azanium

Systemtic Name: methyl-(1-methylpiperidin-1-ium-4-yl)-[(2,5,7-trimethyl-4-oxidanylidene-1H-quinolin-3-yl)methyl]azanium Openeye Name: methyl-(1-methylpiperidin-1-ium-4-yl)-[(2,5,7-trimethyl-4-oxo-1H-quinolin-3-yl)methyl]ammonium CAS Name: methyl-(1-methyl-4-piperidin-1-iumyl)-[(2,5,7-trimethyl-4-oxo-1H-quinolin-3-yl)methyl]ammonium IUPAC Name: methyl-(1-methylpiperidin-1-ium-4-yl)-[(2,5,7-trimethyl-4-oxo-1H-quinolin-3-yl)methyl]azanium Traditional Name: (4-keto-2,5,7-trimethyl-1H-quinolin-3-yl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C20H31N3O+2 MolecularWeight: 329.47964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)NC(=C(C2=O)C[NH+](C)C3CC[NH+](CC3)C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)NC(=C(C2=O)C[NH+](C)C3CC[NH+](CC3)C)C)C

InChI

InChI=1S/C20H29N3O/c1-13-10-14(2)19-18(11-13)21-15(3)17(20(19)24)12-23(5)16-6-8-22(4)9-7-16/h10-11,16H,6-9,12H2,1-5H3,(H,21,24)/p+2