3-bromanyl-5-chloranyl-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzenecarbonitrile

Systemtic Name: 3-bromanyl-5-chloranyl-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzenecarbonitrile Openeye Name: 3-bromo-5-chloro-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzonitrile CAS Name: 3-bromo-5-chloro-2-[2-(1-pyrrolidin-1-iumyl)ethoxy]benzonitrile IUPAC Name: 3-bromo-5-chloro-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzonitrile Traditional Name: 3-bromo-5-chloro-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzonitrile Formula: C13H15BrClN2O+ MolecularWeight: 330.628

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCOC2=C(C=C(C=C2C#N)Cl)Br

Isomeric SMILES

C1CC[NH+](C1)CCOC2=C(C=C(C=C2C#N)Cl)Br

InChI

InChI=1S/C13H14BrClN2O/c14-12-8-11(15)7-10(9-16)13(12)18-6-5-17-3-1-2-4-17/h7-8H,1-6H2/p+1