3-[4-(2-chloranylethanoyl)piperazin-1-ium-1-yl]propanenitrile

Systemtic Name: 3-[4-(2-chloranylethanoyl)piperazin-1-ium-1-yl]propanenitrile Openeye Name: 3-[4-(2-chloroacetyl)piperazin-1-ium-1-yl]propanenitrile CAS Name: 3-[4-(2-chloro-1-oxoethyl)-1-piperazin-1-iumyl]propanenitrile IUPAC Name: 3-[4-(2-chloroacetyl)piperazin-1-ium-1-yl]propanenitrile Traditional Name: 3-[4-(2-chloroacetyl)piperazin-1-ium-1-yl]propionitrile Formula: C9H15ClN3O+ MolecularWeight: 216.6879

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC#N)C(=O)CCl

Isomeric SMILES

C1CN(CC[NH+]1CCC#N)C(=O)CCl

InChI

InChI=1S/C9H14ClN3O/c10-8-9(14)13-6-4-12(5-7-13)3-1-2-11/h1,3-8H2/p+1