2-azanyl-4-pyridin-1-ium-3-yl-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile

Systemtic Name: 2-azanyl-4-pyridin-1-ium-3-yl-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile Openeye Name: 2-amino-4-pyridin-1-ium-3-yl-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile CAS Name: 2-amino-4-(3-pyridin-1-iumyl)-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile IUPAC Name: 2-amino-4-pyridin-1-ium-3-yl-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile Traditional Name: 2-amino-4-pyridin-1-ium-3-yl-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile Formula: C18H16N5+ MolecularWeight: 302.35314

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=C[NH+]=CC=C3

Isomeric SMILES

C1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=C[NH+]=CC=C3

InChI

InChI=1S/C18H15N5/c19-8-15-13-5-1-2-6-14(13)16(12-4-3-7-23-9-12)18(10-20,11-21)17(15)22/h3-5,7,9,14,16H,1-2,6,22H2/p+1