2-[4,7-bis(oxidanylidene)-3a,5,6,7a-tetrahydro-[1,2,3]triazolo[4,5-d]pyridazin-3-yl]ethanoic acid

Systemtic Name: 2-[4,7-bis(oxidanylidene)-3a,5,6,7a-tetrahydro-[1,2,3]triazolo[4,5-d]pyridazin-3-yl]ethanoic acid Openeye Name: 2-(4,7-dioxo-3a,5,6,7a-tetrahydrotriazolo[4,5-d]pyridazin-3-yl)acetic acid CAS Name: 2-(4,7-dioxo-3a,5,6,7a-tetrahydrotriazolo[4,5-d]pyridazin-3-yl)acetic acid IUPAC Name: 2-(4,7-dioxo-3a,5,6,7a-tetrahydrotriazolo[4,5-d]pyridazin-3-yl)acetic acid Traditional Name: 2-(4,7-diketo-3a,5,6,7a-tetrahydrotriazolo[4,5-d]pyridazin-3-yl)acetic acid Formula: C6H7N5O4 MolecularWeight: 213.15088

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)O)N1C2C(C(=O)NNC2=O)N=N1

Isomeric SMILES

C(C(=O)O)N1C2C(C(=O)NNC2=O)N=N1

InChI

InChI=1S/C6H7N5O4/c12-2(13)1-11-4-3(7-10-11)5(14)8-9-6(4)15/h3-4H,1H2,(H,8,14)(H,9,15)(H,12,13)