1-[4-(phenylmethyl)piperazin-4-ium-1-yl]cyclopentane-1-carbonitrile

Systemtic Name: 1-[4-(phenylmethyl)piperazin-4-ium-1-yl]cyclopentane-1-carbonitrile Openeye Name: 1-(4-benzylpiperazin-4-ium-1-yl)cyclopentanecarbonitrile CAS Name: 1-[4-(phenylmethyl)-1-piperazin-4-iumyl]-1-cyclopentanecarbonitrile IUPAC Name: 1-(4-benzylpiperazin-4-ium-1-yl)cyclopentane-1-carbonitrile Traditional Name: 1-(4-benzylpiperazin-4-ium-1-yl)cyclopentanecarbonitrile Formula: C17H24N3+ MolecularWeight: 270.39256

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

C1CCC(C1)(C#N)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C17H23N3/c18-15-17(8-4-5-9-17)20-12-10-19(11-13-20)14-16-6-2-1-3-7-16/h1-3,6-7H,4-5,8-14H2/p+1