1H-benzotriazol-1-ium; phenyl carbonate

Systemtic Name: 1H-benzotriazol-1-ium; phenyl carbonate Openeye Name: 1H-benzotriazol-1-ium; phenyl carbonate CAS Name: 1H-benzotriazol-1-ium; phenyl carbonate IUPAC Name: 1H-benzotriazol-1-ium; phenyl carbonate Traditional Name: 1H-benzotriazol-1-ium; phenyl carbonate Formula: C13H11N3O3 MolecularWeight: 257.24474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)[O-].C1=CC=C2C(=C1)[NH2+]N=N2

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)[O-].C1=CC=C2C(=C1)[NH2+]N=N2

InChI

InChI=1S/C7H6O3.C6H5N3/c8-7(9)10-6-4-2-1-3-5-6;1-2-4-6-5(3-1)7-9-8-6/h1-5H,(H,8,9);1-4H,(H,7,8,9)