2-[4-(morpholin-4-ium-4-ylmethyl)phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-(morpholin-4-ium-4-ylmethyl)phenyl]benzenecarbonitrile Openeye Name: 2-[4-(morpholin-4-ium-4-ylmethyl)phenyl]benzonitrile CAS Name: 2-[4-(4-morpholin-4-iumylmethyl)phenyl]benzonitrile IUPAC Name: 2-[4-(morpholin-4-ium-4-ylmethyl)phenyl]benzonitrile Traditional Name: 2-[4-(morpholin-4-ium-4-ylmethyl)phenyl]benzonitrile Formula: C18H19N2O+ MolecularWeight: 279.35626

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

C1COCC[NH+]1CC2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C18H18N2O/c19-13-17-3-1-2-4-18(17)16-7-5-15(6-8-16)14-20-9-11-21-12-10-20/h1-8H,9-12,14H2/p+1