4-[(4-heptylmorpholin-4-ium-4-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(4-heptylmorpholin-4-ium-4-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(4-heptylmorpholin-4-ium-4-yl)methyl]benzonitrile CAS Name: 4-[(4-heptyl-4-morpholin-4-iumyl)methyl]benzonitrile IUPAC Name: 4-[(4-heptylmorpholin-4-ium-4-yl)methyl]benzonitrile Traditional Name: 4-[(4-heptylmorpholin-4-ium-4-yl)methyl]benzonitrile Formula: C19H29N2O+ MolecularWeight: 301.44636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+]1(CCOCC1)CC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCCC[N+]1(CCOCC1)CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H29N2O/c1-2-3-4-5-6-11-21(12-14-22-15-13-21)17-19-9-7-18(16-20)8-10-19/h7-10H,2-6,11-15,17H2,1H3/q+1