6-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methylamino]pyridine-3-carbonitrile

Systemtic Name: 6-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methylamino]pyridine-3-carbonitrile Openeye Name: 6-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methylamino]pyridine-3-carbonitrile CAS Name: 6-[[4-[(4-methyl-1-piperidin-1-iumyl)methyl]phenyl]methylamino]-3-pyridinecarbonitrile IUPAC Name: 6-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methylamino]pyridine-3-carbonitrile Traditional Name: 6-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]benzyl]amino]nicotinonitrile Formula: C20H25N4+ MolecularWeight: 321.4393

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=CC=C(C=C2)CNC3=NC=C(C=C3)C#N

Isomeric SMILES

CC1CC[NH+](CC1)CC2=CC=C(C=C2)CNC3=NC=C(C=C3)C#N

InChI

InChI=1S/C20H24N4/c1-16-8-10-24(11-9-16)15-18-4-2-17(3-5-18)13-22-20-7-6-19(12-21)14-23-20/h2-7,14,16H,8-11,13,15H2,1H3,(H,22,23)/p+1