2-azanyl-6-[bis(2-hydroxyethyl)amino]-4-(cyanomethyl)pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-[bis(2-hydroxyethyl)amino]-4-(cyanomethyl)pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-6-[bis(2-hydroxyethyl)amino]-4-(cyanomethyl)pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-6-[bis(2-hydroxyethyl)amino]-4-(cyanomethyl)pyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-6-[bis(2-hydroxyethyl)amino]-4-(cyanomethyl)pyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-6-[bis(2-hydroxyethyl)amino]-4-(cyanomethyl)pyridin-1-ium-3,5-dicarbonitrile Formula: C13H15N6O2+ MolecularWeight: 287.2972

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Descriptors Computed from Structure

Canonical SMILES:

C(CO)N(CCO)C1=C(C(=C(C(=[NH+]1)N)C#N)CC#N)C#N

Isomeric SMILES

C(CO)N(CCO)C1=C(C(=C(C(=[NH+]1)N)C#N)CC#N)C#N

InChI

InChI=1S/C13H14N6O2/c14-2-1-9-10(7-15)12(17)18-13(11(9)8-16)19(3-5-20)4-6-21/h20-21H,1,3-6H2,(H2,17,18)/p+1