1-azanylidene-2H-indol-1-ium-3-imine; 3-nitrobenzenecarbonitrile

Systemtic Name: 1-azanylidene-2H-indol-1-ium-3-imine; 3-nitrobenzenecarbonitrile Openeye Name: 1-iminoindolin-1-ium-3-imine; 3-nitrobenzonitrile CAS Name: 1-imino-2H-indol-1-ium-3-imine; 3-nitrobenzonitrile IUPAC Name: 1-imino-2H-indol-1-ium-3-imine; 3-nitrobenzonitrile Traditional Name: (1-iminoindolin-1-ium-3-ylidene)amine; 3-nitrobenzonitrile Formula: C15H12N5O2+ MolecularWeight: 294.28808

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=N)C2=CC=CC=C2[N+]1=N.C1=CC(=CC(=C1)[N+](=O)[O-])C#N

Isomeric SMILES

C1C(=N)C2=CC=CC=C2[N+]1=N.C1=CC(=CC(=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C8H8N3.C7H4N2O2/c9-7-5-11(10)8-4-2-1-3-6(7)8;8-5-6-2-1-3-7(4-6)9(10)11/h1-4,9-10H,5H2;1-4H/q+1;