4-[4-(2,3-dimethylphenyl)piperazin-1-yl]piperidin-1-ium-4-carbonitrile

Systemtic Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]piperidin-1-ium-4-carbonitrile Openeye Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]piperidin-1-ium-4-carbonitrile CAS Name: 4-[4-(2,3-dimethylphenyl)-1-piperazinyl]-4-piperidin-1-iumcarbonitrile IUPAC Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]piperidin-1-ium-4-carbonitrile Traditional Name: 4-[4-(2,3-dimethylphenyl)piperazino]piperidin-1-ium-4-carbonitrile Formula: C18H27N4+ MolecularWeight: 299.43378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C3(CC[NH2+]CC3)C#N)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C3(CC[NH2+]CC3)C#N)C

InChI

InChI=1S/C18H26N4/c1-15-4-3-5-17(16(15)2)21-10-12-22(13-11-21)18(14-19)6-8-20-9-7-18/h3-5,20H,6-13H2,1-2H3/p+1