1-methyl-4-[(3-methylphenyl)methylamino]piperidin-1-ium-4-carbonitrile

Systemtic Name: 1-methyl-4-[(3-methylphenyl)methylamino]piperidin-1-ium-4-carbonitrile Openeye Name: 1-methyl-4-(m-tolylmethylamino)piperidin-1-ium-4-carbonitrile CAS Name: 1-methyl-4-[(3-methylphenyl)methylamino]-4-piperidin-1-iumcarbonitrile IUPAC Name: 1-methyl-4-[(3-methylphenyl)methylamino]piperidin-1-ium-4-carbonitrile Traditional Name: 1-methyl-4-[(3-methylbenzyl)amino]piperidin-1-ium-4-carbonitrile Formula: C15H22N3+ MolecularWeight: 244.35528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC2(CC[NH+](CC2)C)C#N

Isomeric SMILES

CC1=CC(=CC=C1)CNC2(CC[NH+](CC2)C)C#N

InChI

InChI=1S/C15H21N3/c1-13-4-3-5-14(10-13)11-17-15(12-16)6-8-18(2)9-7-15/h3-5,10,17H,6-9,11H2,1-2H3/p+1