(3-oxidanylidenecyclohexen-1-yl) 1-methylbenzotriazole-5-carboxylate

Systemtic Name: (3-oxidanylidenecyclohexen-1-yl) 1-methylbenzotriazole-5-carboxylate Openeye Name: (3-oxocyclohexen-1-yl) 1-methylbenzotriazole-5-carboxylate CAS Name: 1-methyl-5-benzotriazolecarboxylic acid (3-oxo-1-cyclohexenyl) ester IUPAC Name: (3-oxocyclohexen-1-yl) 1-methylbenzotriazole-5-carboxylate Traditional Name: 1-methylbenzotriazole-5-carboxylic acid (3-ketocyclohexen-1-yl) ester Formula: C14H13N3O3 MolecularWeight: 271.27132

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)OC3=CC(=O)CCC3)N=N1

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)OC3=CC(=O)CCC3)N=N1

InChI

InChI=1S/C14H13N3O3/c1-17-13-6-5-9(7-12(13)15-16-17)14(19)20-11-4-2-3-10(18)8-11/h5-8H,2-4H2,1H3