2-[2-[2-(3-azanyl-5-oxidanylidene-2H-1,2,4-triazin-6-yl)hydrazinyl]-2-oxidanylidene-ethoxy]ethyl benzoate

Systemtic Name: 2-[2-[2-(3-azanyl-5-oxidanylidene-2H-1,2,4-triazin-6-yl)hydrazinyl]-2-oxidanylidene-ethoxy]ethyl benzoate Openeye Name: 2-[2-[2-(3-amino-5-oxo-2H-1,2,4-triazin-6-yl)hydrazino]-2-oxo-ethoxy]ethyl benzoate CAS Name: benzoic acid 2-[2-[(3-amino-5-oxo-2H-1,2,4-triazin-6-yl)hydrazo]-2-oxoethoxy]ethyl ester IUPAC Name: 2-[2-[2-(3-amino-5-oxo-2H-1,2,4-triazin-6-yl)hydrazinyl]-2-oxoethoxy]ethyl benzoate Traditional Name: benzoic acid 2-[2-[N'-(3-amino-5-keto-2H-1,2,4-triazin-6-yl)hydrazino]-2-keto-ethoxy]ethyl ester Formula: C14H16N6O5 MolecularWeight: 348.31404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCOCC(=O)NNC2=NNC(=NC2=O)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCOCC(=O)NNC2=NNC(=NC2=O)N

InChI

InChI=1S/C14H16N6O5/c15-14-16-12(22)11(19-20-14)18-17-10(21)8-24-6-7-25-13(23)9-4-2-1-3-5-9/h1-5H,6-8H2,(H,17,21)(H,18,19)(H3,15,16,20,22)