4-[[(E)-1-[4-(5-oxidanylidene-2H-1,2,3-oxadiazol-3-ium-3-yl)phenyl]ethylideneamino]carbamoyl]phenolate

Systemtic Name: 4-[[(E)-1-[4-(5-oxidanylidene-2H-1,2,3-oxadiazol-3-ium-3-yl)phenyl]ethylideneamino]carbamoyl]phenolate Openeye Name: 4-[[(E)-1-[4-(5-oxo-2H-oxadiazol-3-ium-3-yl)phenyl]ethylideneamino]carbamoyl]phenolate CAS Name: 4-[oxo-[(2E)-2-[1-[4-(5-oxo-2H-oxadiazol-3-ium-3-yl)phenyl]ethylidene]hydrazinyl]methyl]phenolate IUPAC Name: 4-[[(E)-1-[4-(5-oxo-2H-oxadiazol-3-ium-3-yl)phenyl]ethylideneamino]carbamoyl]phenolate Traditional Name: 4-[[(E)-1-[4-(5-keto-2H-oxadiazol-3-ium-3-yl)phenyl]ethylideneamino]carbamoyl]phenolate Formula: C17H14N4O4 MolecularWeight: 338.31746

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)[O-])C2=CC=C(C=C2)[N+]3=CC(=O)ON3

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=C(C=C1)[O-])/C2=CC=C(C=C2)[N+]3=CC(=O)ON3

InChI

InChI=1S/C17H14N4O4/c1-11(18-19-17(24)13-4-8-15(22)9-5-13)12-2-6-14(7-3-12)21-10-16(23)25-20-21/h2-10H,1H3,(H2-,19,20,22,23,24)