[2-(2,6-dimethylphenoxy)pyridin-3-yl]methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [2-(2,6-dimethylphenoxy)pyridin-3-yl]methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [2-(2,6-dimethylphenoxy)-3-pyridyl]methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [2-(2,6-dimethylphenoxy)-3-pyridinyl]methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [2-(2,6-dimethylphenoxy)pyridin-3-yl]methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [2-(2,6-dimethylphenoxy)-3-pyridyl]methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C20H29N3O+2 MolecularWeight: 327.46376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC2=C(C=CC=N2)C[NH2+]C3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC2=C(C=CC=N2)C[NH2+]C3CC[NH+](CC3)C

InChI

InChI=1S/C20H27N3O/c1-15-6-4-7-16(2)19(15)24-20-17(8-5-11-21-20)14-22-18-9-12-23(3)13-10-18/h4-8,11,18,22H,9-10,12-14H2,1-3H3/p+2