2-azanyl-6-[(5-chloranyl-2-methyl-phenyl)amino]-4-(cyanomethyl)pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-[(5-chloranyl-2-methyl-phenyl)amino]-4-(cyanomethyl)pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-6-(5-chloro-2-methyl-anilino)-4-(cyanomethyl)pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-6-(5-chloro-2-methylanilino)-4-(cyanomethyl)pyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-6-(5-chloro-2-methylanilino)-4-(cyanomethyl)pyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-6-(5-chloro-2-methyl-anilino)-4-(cyanomethyl)pyridin-1-ium-3,5-dicarbonitrile Formula: C16H12ClN6+ MolecularWeight: 323.75968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC2=C(C(=C(C(=[NH+]2)N)C#N)CC#N)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC2=C(C(=C(C(=[NH+]2)N)C#N)CC#N)C#N

InChI

InChI=1S/C16H11ClN6/c1-9-2-3-10(17)6-14(9)22-16-13(8-20)11(4-5-18)12(7-19)15(21)23-16/h2-3,6H,4H2,1H3,(H3,21,22,23)/p+1