2-(2-morpholin-4-ium-4-ylethylamino)-5-phenyl-pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-(2-morpholin-4-ium-4-ylethylamino)-5-phenyl-pyridin-1-ium-3-carbonitrile Openeye Name: 2-(2-morpholin-4-ium-4-ylethylamino)-5-phenyl-pyridin-1-ium-3-carbonitrile CAS Name: 2-[2-(4-morpholin-4-iumyl)ethylamino]-5-phenyl-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-(2-morpholin-4-ium-4-ylethylamino)-5-phenylpyridin-1-ium-3-carbonitrile Traditional Name: 2-(2-morpholin-4-ium-4-ylethylamino)-5-phenyl-pyridin-1-ium-3-carbonitrile Formula: C18H22N4O+2 MolecularWeight: 310.39348

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC2=[NH+]C=C(C=C2C#N)C3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CCNC2=[NH+]C=C(C=C2C#N)C3=CC=CC=C3

InChI

InChI=1S/C18H20N4O/c19-13-16-12-17(15-4-2-1-3-5-15)14-21-18(16)20-6-7-22-8-10-23-11-9-22/h1-5,12,14H,6-11H2,(H,20,21)/p+2