5-bromanyl-2-(2-piperidin-1-ium-1-ylethoxy)benzenecarbonitrile

Systemtic Name: 5-bromanyl-2-(2-piperidin-1-ium-1-ylethoxy)benzenecarbonitrile Openeye Name: 5-bromo-2-(2-piperidin-1-ium-1-ylethoxy)benzonitrile CAS Name: 5-bromo-2-[2-(1-piperidin-1-iumyl)ethoxy]benzonitrile IUPAC Name: 5-bromo-2-(2-piperidin-1-ium-1-ylethoxy)benzonitrile Traditional Name: 5-bromo-2-(2-piperidin-1-ium-1-ylethoxy)benzonitrile Formula: C14H18BrN2O+ MolecularWeight: 310.20952

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCOC2=C(C=C(C=C2)Br)C#N

Isomeric SMILES

C1CC[NH+](CC1)CCOC2=C(C=C(C=C2)Br)C#N

InChI

InChI=1S/C14H17BrN2O/c15-13-4-5-14(12(10-13)11-16)18-9-8-17-6-2-1-3-7-17/h4-5,10H,1-3,6-9H2/p+1