2-methylpropyl 3-oxidanidylbenzotriazol-3-ium-1-carboxylate

Systemtic Name: 2-methylpropyl 3-oxidanidylbenzotriazol-3-ium-1-carboxylate Openeye Name: isobutyl 3-oxidobenzotriazol-3-ium-1-carboxylate CAS Name: 3-oxido-1-benzotriazol-3-iumcarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-oxidobenzotriazol-3-ium-1-carboxylate Traditional Name: 3-oxidobenzotriazol-3-ium-1-carboxylic acid isobutyl ester Formula: C11H13N3O3 MolecularWeight: 235.23922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)N1C2=CC=CC=C2[N+](=N1)[O-]

Isomeric SMILES

CC(C)COC(=O)N1C2=CC=CC=C2[N+](=N1)[O-]

InChI

InChI=1S/C11H13N3O3/c1-8(2)7-17-11(15)13-9-5-3-4-6-10(9)14(16)12-13/h3-6,8H,7H2,1-2H3