[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 1-ethylbenzotriazole-5-carboxylate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 1-ethylbenzotriazole-5-carboxylate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 1-ethylbenzotriazole-5-carboxylate CAS Name: 1-ethyl-5-benzotriazolecarboxylic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 1-ethylbenzotriazole-5-carboxylate Traditional Name: 1-ethylbenzotriazole-5-carboxylic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C19H18FN3O3 MolecularWeight: 355.362923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18FN3O3/c1-2-23-17-10-7-14(12-16(17)21-22-23)19(25)26-11-3-4-18(24)13-5-8-15(20)9-6-13/h5-10,12H,2-4,11H2,1H3