4-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]butanenitrile

Systemtic Name: 4-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]butanenitrile Openeye Name: 4-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]butanenitrile CAS Name: 4-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]butanenitrile IUPAC Name: 4-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]butanenitrile Traditional Name: 4-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]butyronitrile Formula: C14H20N3O+ MolecularWeight: 246.3281

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCC#N)C2=CC=C(C=C2)O

Isomeric SMILES

C1CN(CC[NH+]1CCCC#N)C2=CC=C(C=C2)O

InChI

InChI=1S/C14H19N3O/c15-7-1-2-8-16-9-11-17(12-10-16)13-3-5-14(18)6-4-13/h3-6,18H,1-2,8-12H2/p+1