3-ethoxy-4-(2-morpholin-4-ium-4-ylethoxy)benzenecarbonitrile

Systemtic Name: 3-ethoxy-4-(2-morpholin-4-ium-4-ylethoxy)benzenecarbonitrile Openeye Name: 3-ethoxy-4-(2-morpholin-4-ium-4-ylethoxy)benzonitrile CAS Name: 3-ethoxy-4-[2-(4-morpholin-4-iumyl)ethoxy]benzonitrile IUPAC Name: 3-ethoxy-4-(2-morpholin-4-ium-4-ylethoxy)benzonitrile Traditional Name: 3-ethoxy-4-(2-morpholin-4-ium-4-ylethoxy)benzonitrile Formula: C15H21N2O3+ MolecularWeight: 277.33884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OCC[NH+]2CCOCC2

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OCC[NH+]2CCOCC2

InChI

InChI=1S/C15H20N2O3/c1-2-19-15-11-13(12-16)3-4-14(15)20-10-7-17-5-8-18-9-6-17/h3-4,11H,2,5-10H2,1H3/p+1