4-nitro-2-[(Z)-1,2,4-triazol-4-yliminomethyl]naphthalen-1-olate

Systemtic Name: 4-nitro-2-[(Z)-1,2,4-triazol-4-yliminomethyl]naphthalen-1-olate Openeye Name: 4-nitro-2-[(Z)-1,2,4-triazol-4-yliminomethyl]naphthalen-1-olate CAS Name: 4-nitro-2-[(Z)-1,2,4-triazol-4-yliminomethyl]-1-naphthalenolate IUPAC Name: 4-nitro-2-[(Z)-1,2,4-triazol-4-yliminomethyl]naphthalen-1-olate Traditional Name: 4-nitro-2-[(Z)-1,2,4-triazol-4-yliminomethyl]naphthalen-1-olate Formula: C13H8N5O3- MolecularWeight: 282.23432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=C2[O-])C=NN3C=NN=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C2[O-])/C=N\N3C=NN=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H9N5O3/c19-13-9(6-16-17-7-14-15-8-17)5-12(18(20)21)10-3-1-2-4-11(10)13/h1-8,19H/p-1/b16-6-