2-(2H-1,2,3,4-tetrazol-5-yl)-3,1-benzoxazin-1-ium-4-one

Systemtic Name: 2-(2H-1,2,3,4-tetrazol-5-yl)-3,1-benzoxazin-1-ium-4-one Openeye Name: 2-(2H-tetrazol-5-yl)-3,1-benzoxazin-1-ium-4-one CAS Name: 2-(2H-tetrazol-5-yl)-3,1-benzoxazin-1-ium-4-one IUPAC Name: 2-(2H-tetrazol-5-yl)-3,1-benzoxazin-1-ium-4-one Traditional Name: 2-(2H-tetrazol-5-yl)-3,1-benzoxazin-1-ium-4-one Formula: C9H6N5O2+ MolecularWeight: 216.17624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)OC(=[NH+]2)C3=NNN=N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)OC(=[NH+]2)C3=NNN=N3

InChI

InChI=1S/C9H5N5O2/c15-9-5-3-1-2-4-6(5)10-8(16-9)7-11-13-14-12-7/h1-4H,(H,11,12,13,14)/p+1