6-[(2-methylquinolin-4-yl)amino]pyridin-1-ium-3-carbonitrile

Systemtic Name: 6-[(2-methylquinolin-4-yl)amino]pyridin-1-ium-3-carbonitrile Openeye Name: 6-[(2-methyl-4-quinolyl)amino]pyridin-1-ium-3-carbonitrile CAS Name: 6-[(2-methyl-4-quinolinyl)amino]-3-pyridin-1-iumcarbonitrile IUPAC Name: 6-[(2-methylquinolin-4-yl)amino]pyridin-1-ium-3-carbonitrile Traditional Name: 6-[(2-methyl-4-quinolyl)amino]pyridin-1-ium-3-carbonitrile Formula: C16H13N4+ MolecularWeight: 261.30122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC3=[NH+]C=C(C=C3)C#N

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC3=[NH+]C=C(C=C3)C#N

InChI

InChI=1S/C16H12N4/c1-11-8-15(13-4-2-3-5-14(13)19-11)20-16-7-6-12(9-17)10-18-16/h2-8,10H,1H3,(H,18,19,20)/p+1