phenyl 1-methylbenzotriazole-5-carboxylate

Systemtic Name: phenyl 1-methylbenzotriazole-5-carboxylate Openeye Name: phenyl 1-methylbenzotriazole-5-carboxylate CAS Name: 1-methyl-5-benzotriazolecarboxylic acid phenyl ester IUPAC Name: phenyl 1-methylbenzotriazole-5-carboxylate Traditional Name: 1-methylbenzotriazole-5-carboxylic acid phenyl ester Formula: C14H11N3O2 MolecularWeight: 253.25604

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)OC3=CC=CC=C3)N=N1

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)OC3=CC=CC=C3)N=N1

InChI

InChI=1S/C14H11N3O2/c1-17-13-8-7-10(9-12(13)15-16-17)14(18)19-11-5-3-2-4-6-11/h2-9H,1H3