1-(2,4-dichlorophenyl)-5-(5-piperidin-1-ylpentyl)-1,2,4-triazol-1-ium-1-carbonitrile

Systemtic Name: 1-(2,4-dichlorophenyl)-5-(5-piperidin-1-ylpentyl)-1,2,4-triazol-1-ium-1-carbonitrile Openeye Name: 1-(2,4-dichlorophenyl)-5-[5-(1-piperidyl)pentyl]-1,2,4-triazol-1-ium-1-carbonitrile CAS Name: 1-(2,4-dichlorophenyl)-5-[5-(1-piperidinyl)pentyl]-1,2,4-triazol-1-ium-1-carbonitrile IUPAC Name: 1-(2,4-dichlorophenyl)-5-(5-piperidin-1-ylpentyl)-1,2,4-triazol-1-ium-1-carbonitrile Traditional Name: 1-(2,4-dichlorophenyl)-5-(5-piperidinopentyl)-1,2,4-triazol-1-ium-1-carbonitrile Formula: C19H24Cl2N5+ MolecularWeight: 393.33336

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCCC2=NC=N[N+]2(C#N)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCN(CC1)CCCCCC2=NC=N[N+]2(C#N)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H24Cl2N5/c20-16-8-9-18(17(21)13-16)26(14-22)19(23-15-24-26)7-3-1-4-10-25-11-5-2-6-12-25/h8-9,13,15H,1-7,10-12H2/q+1