2-phenoxyethyl 1-ethylbenzotriazole-5-carboxylate

Systemtic Name: 2-phenoxyethyl 1-ethylbenzotriazole-5-carboxylate Openeye Name: 2-phenoxyethyl 1-ethylbenzotriazole-5-carboxylate CAS Name: 1-ethyl-5-benzotriazolecarboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 1-ethylbenzotriazole-5-carboxylate Traditional Name: 1-ethylbenzotriazole-5-carboxylic acid 2-phenoxyethyl ester Formula: C17H17N3O3 MolecularWeight: 311.33518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCCOC3=CC=CC=C3)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCCOC3=CC=CC=C3)N=N1

InChI

InChI=1S/C17H17N3O3/c1-2-20-16-9-8-13(12-15(16)18-19-20)17(21)23-11-10-22-14-6-4-3-5-7-14/h3-9,12H,2,10-11H2,1H3