[7-methyl-2-(4-oxidanylpiperidin-1-yl)quinolin-1-ium-3-yl]methyl-phenethyl-azanium

Systemtic Name: [7-methyl-2-(4-oxidanylpiperidin-1-yl)quinolin-1-ium-3-yl]methyl-phenethyl-azanium Openeye Name: [2-(4-hydroxy-1-piperidyl)-7-methyl-quinolin-1-ium-3-yl]methyl-phenethyl-ammonium CAS Name: [2-(4-hydroxy-1-piperidinyl)-7-methyl-3-quinolin-1-iumyl]methyl-phenethylammonium IUPAC Name: [2-(4-hydroxypiperidin-1-yl)-7-methylquinolin-1-ium-3-yl]methyl-phenethylazanium Traditional Name: [2-(4-hydroxypiperidino)-7-methyl-quinolin-1-ium-3-yl]methyl-phenethyl-ammonium Formula: C24H31N3O+2 MolecularWeight: 377.52244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=[NH+]C(=C(C=C2C=C1)C[NH2+]CCC3=CC=CC=C3)N4CCC(CC4)O

Isomeric SMILES

CC1=CC2=[NH+]C(=C(C=C2C=C1)C[NH2+]CCC3=CC=CC=C3)N4CCC(CC4)O

InChI

InChI=1S/C24H29N3O/c1-18-7-8-20-16-21(17-25-12-9-19-5-3-2-4-6-19)24(26-23(20)15-18)27-13-10-22(28)11-14-27/h2-8,15-16,22,25,28H,9-14,17H2,1H3/p+2