4-methyl-1-(4-phenylpiperazin-1-ium-1-yl)cyclohexane-1-carbonitrile

Systemtic Name: 4-methyl-1-(4-phenylpiperazin-1-ium-1-yl)cyclohexane-1-carbonitrile Openeye Name: 4-methyl-1-(4-phenylpiperazin-1-ium-1-yl)cyclohexanecarbonitrile CAS Name: 4-methyl-1-(4-phenyl-1-piperazin-1-iumyl)-1-cyclohexanecarbonitrile IUPAC Name: 4-methyl-1-(4-phenylpiperazin-1-ium-1-yl)cyclohexane-1-carbonitrile Traditional Name: 4-methyl-1-(4-phenylpiperazin-1-ium-1-yl)cyclohexanecarbonitrile Formula: C18H26N3+ MolecularWeight: 284.41914

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C#N)[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1CCC(CC1)(C#N)[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C18H25N3/c1-16-7-9-18(15-19,10-8-16)21-13-11-20(12-14-21)17-5-3-2-4-6-17/h2-6,16H,7-14H2,1H3/p+1