6-(phenylmethyl)-6-azoniaspiro[2.5]octane-1,1,2,2-tetracarbonitrile

Systemtic Name: 6-(phenylmethyl)-6-azoniaspiro[2.5]octane-1,1,2,2-tetracarbonitrile Openeye Name: 6-benzyl-6-azoniaspiro[2.5]octane-1,1,2,2-tetracarbonitrile CAS Name: 6-(phenylmethyl)-6-azoniaspiro[2.5]octane-1,1,2,2-tetracarbonitrile IUPAC Name: 6-benzyl-6-azoniaspiro[2.5]octane-1,1,2,2-tetracarbonitrile Traditional Name: 6-benzyl-6-azoniaspiro[2.5]octane-1,1,2,2-tetracarbonitrile Formula: C18H16N5+ MolecularWeight: 302.35314

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC12C(C2(C#N)C#N)(C#N)C#N)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC12C(C2(C#N)C#N)(C#N)C#N)CC3=CC=CC=C3

InChI

InChI=1S/C18H15N5/c19-11-17(12-20)16(18(17,13-21)14-22)6-8-23(9-7-16)10-15-4-2-1-3-5-15/h1-5H,6-10H2/p+1