2-azanyl-4-pyridin-1-ium-4-yl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-pyridin-1-ium-4-yl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile Openeye Name: 2-amino-4-pyridin-1-ium-4-yl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile CAS Name: 2-amino-4-(4-pyridin-1-iumyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile IUPAC Name: 2-amino-4-pyridin-1-ium-4-yl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile Traditional Name: 2-amino-4-pyridin-1-ium-4-yl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile Formula: C16H17N4+ MolecularWeight: 265.33298

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)N=C(C(=C2C3=CC=[NH+]C=C3)C#N)N

Isomeric SMILES

C1CCC2=C(CC1)N=C(C(=C2C3=CC=[NH+]C=C3)C#N)N

InChI

InChI=1S/C16H16N4/c17-10-13-15(11-6-8-19-9-7-11)12-4-2-1-3-5-14(12)20-16(13)18/h6-9H,1-5H2,(H2,18,20)/p+1