2-[(1-methylpiperazin-1-ium-1-yl)methyl]prop-2-enenitrile

Systemtic Name: 2-[(1-methylpiperazin-1-ium-1-yl)methyl]prop-2-enenitrile Openeye Name: 2-[(1-methylpiperazin-1-ium-1-yl)methyl]prop-2-enenitrile CAS Name: 2-[(1-methyl-1-piperazin-1-iumyl)methyl]-2-propenenitrile IUPAC Name: 2-[(1-methylpiperazin-1-ium-1-yl)methyl]prop-2-enenitrile Traditional Name: 2-[(1-methylpiperazin-1-ium-1-yl)methyl]acrylonitrile Formula: C9H16N3+ MolecularWeight: 166.24344

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCNCC1)CC(=C)C#N

Isomeric SMILES

C[N+]1(CCNCC1)CC(=C)C#N

InChI

InChI=1S/C9H16N3/c1-9(7-10)8-12(2)5-3-11-4-6-12/h11H,1,3-6,8H2,2H3/q+1