3-(morpholin-4-ium-4-ylmethyl)benzenecarbonitrile

Systemtic Name: 3-(morpholin-4-ium-4-ylmethyl)benzenecarbonitrile Openeye Name: 3-(morpholin-4-ium-4-ylmethyl)benzonitrile CAS Name: 3-(4-morpholin-4-iumylmethyl)benzonitrile IUPAC Name: 3-(morpholin-4-ium-4-ylmethyl)benzonitrile Traditional Name: 3-(morpholin-4-ium-4-ylmethyl)benzonitrile Formula: C12H15N2O+ MolecularWeight: 203.2603

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CC(=C2)C#N

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC(=C2)C#N

InChI

InChI=1S/C12H14N2O/c13-9-11-2-1-3-12(8-11)10-14-4-6-15-7-5-14/h1-3,8H,4-7,10H2/p+1