4-nitro-2-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-1-olate

Systemtic Name: 4-nitro-2-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-1-olate Openeye Name: 4-nitro-2-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-1-olate CAS Name: 4-nitro-2-(1H-1,2,4-triazol-5-yliminomethyl)-1-naphthalenolate IUPAC Name: 4-nitro-2-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-1-olate Traditional Name: 4-nitro-2-(1H-1,2,4-triazol-5-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=NC3=NC=NN3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C2[O-])C=NC3=NC=NN3)[N+](=O)[O-]

InChI

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