3-azanyl-5-oxidanylidene-N-(xanthen-9-ylideneamino)-2H-1,2,5-oxadiazol-5-ium-4-carboxamide

Systemtic Name: 3-azanyl-5-oxidanylidene-N-(xanthen-9-ylideneamino)-2H-1,2,5-oxadiazol-5-ium-4-carboxamide Openeye Name: 3-amino-5-oxo-N-(xanthen-9-ylideneamino)-2H-1,2,5-oxadiazol-5-ium-4-carboxamide CAS Name: 3-amino-5-oxo-N-(9-xanthenylideneamino)-2H-1,2,5-oxadiazol-5-ium-4-carboxamide IUPAC Name: 3-amino-5-oxo-N-(xanthen-9-ylideneamino)-2H-1,2,5-oxadiazol-5-ium-4-carboxamide Traditional Name: 3-amino-5-keto-N-(xanthen-9-ylideneamino)-2H-furazan-5-ium-4-carboxamide Formula: C16H12N5O4+ MolecularWeight: 338.29758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC(=O)C3=C(NO[N+]3=O)N)C4=CC=CC=C4O2

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC(=O)C3=C(NO[N+]3=O)N)C4=CC=CC=C4O2

InChI

InChI=1S/C16H11N5O4/c17-15-14(21(23)25-20-15)16(22)19-18-13-9-5-1-3-7-11(9)24-12-8-4-2-6-10(12)13/h1-8H,(H3-,17,19,20,22,23)/p+1