(2R)-2-(2-methylphenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanenitrile

Systemtic Name: (2R)-2-(2-methylphenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanenitrile Openeye Name: (2R)-2-(o-tolyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetonitrile CAS Name: (2R)-2-(2-methylphenyl)-2-(4-phenyl-1-piperazin-1-iumyl)acetonitrile IUPAC Name: (2R)-2-(2-methylphenyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetonitrile Traditional Name: (2R)-2-(o-tolyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetonitrile Formula: C19H22N3+ MolecularWeight: 292.39808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C#N)[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1[C@H](C#N)[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3/c1-16-7-5-6-10-18(16)19(15-20)22-13-11-21(12-14-22)17-8-3-2-4-9-17/h2-10,19H,11-14H2,1H3/p+1/t19-/m0/s1