[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 1-ethylbenzotriazole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 1-ethylbenzotriazole-5-carboxylate Openeye Name: [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] 1-ethylbenzotriazole-5-carboxylate CAS Name: 1-ethyl-5-benzotriazolecarboxylic acid [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] 1-ethylbenzotriazole-5-carboxylate Traditional Name: 1-ethylbenzotriazole-5-carboxylic acid [2-keto-2-[3-(trifluoromethyl)anilino]ethyl] ester Formula: C18H15F3N4O3 MolecularWeight: 392.33191

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC(=O)NC3=CC=CC(=C3)C(F)(F)F)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC(=O)NC3=CC=CC(=C3)C(F)(F)F)N=N1

InChI

InChI=1S/C18H15F3N4O3/c1-2-25-15-7-6-11(8-14(15)23-24-25)17(27)28-10-16(26)22-13-5-3-4-12(9-13)18(19,20)21/h3-9H,2,10H2,1H3,(H,22,26)