2-(4-morpholin-4-ium-4-ylbutoxy)benzenecarbonitrile

Systemtic Name: 2-(4-morpholin-4-ium-4-ylbutoxy)benzenecarbonitrile Openeye Name: 2-(4-morpholin-4-ium-4-ylbutoxy)benzonitrile CAS Name: 2-[4-(4-morpholin-4-iumyl)butoxy]benzonitrile IUPAC Name: 2-(4-morpholin-4-ium-4-ylbutoxy)benzonitrile Traditional Name: 2-(4-morpholin-4-ium-4-ylbutoxy)benzonitrile Formula: C15H21N2O2+ MolecularWeight: 261.33944

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCCOC2=CC=CC=C2C#N

Isomeric SMILES

C1COCC[NH+]1CCCCOC2=CC=CC=C2C#N

InChI

InChI=1S/C15H20N2O2/c16-13-14-5-1-2-6-15(14)19-10-4-3-7-17-8-11-18-12-9-17/h1-2,5-6H,3-4,7-12H2/p+1