3-piperazine-1,4-diium-1-ylpropanenitrile

Systemtic Name: 3-piperazine-1,4-diium-1-ylpropanenitrile Openeye Name: 3-piperazine-1,4-diium-1-ylpropanenitrile CAS Name: 3-(1-piperazine-1,4-diiumyl)propanenitrile IUPAC Name: 3-piperazine-1,4-diium-1-ylpropanenitrile Traditional Name: 3-piperazine-1,4-diium-1-ylpropionitrile Formula: C7H15N3+2 MolecularWeight: 141.2141

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CCC#N

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CCC#N

InChI

InChI=1S/C7H13N3/c8-2-1-5-10-6-3-9-4-7-10/h9H,1,3-7H2/p+2