(E)-3-azanyl-3-(4-methylpiperazin-4-ium-1-yl)prop-2-enenitrile

Systemtic Name: (E)-3-azanyl-3-(4-methylpiperazin-4-ium-1-yl)prop-2-enenitrile Openeye Name: (E)-3-amino-3-(4-methylpiperazin-4-ium-1-yl)prop-2-enenitrile CAS Name: (E)-3-amino-3-(4-methyl-1-piperazin-4-iumyl)-2-propenenitrile IUPAC Name: (E)-3-amino-3-(4-methylpiperazin-4-ium-1-yl)prop-2-enenitrile Traditional Name: (E)-3-amino-3-(4-methylpiperazin-4-ium-1-yl)acrylonitrile Formula: C8H15N4+ MolecularWeight: 167.2315

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=CC#N)N

Isomeric SMILES

C[NH+]1CCN(CC1)/C(=C/C#N)/N

InChI

InChI=1S/C8H14N4/c1-11-4-6-12(7-5-11)8(10)2-3-9/h2H,4-7,10H2,1H3/p+1/b8-2+