2-[3-(1,3-dihydrobenzotriazol-2-yl)-4-oxidanyl-phenyl]ethyl 2,2-dimethylbutanoate

Systemtic Name: 2-[3-(1,3-dihydrobenzotriazol-2-yl)-4-oxidanyl-phenyl]ethyl 2,2-dimethylbutanoate Openeye Name: 2-[3-(1,3-dihydrobenzotriazol-2-yl)-4-hydroxy-phenyl]ethyl 2,2-dimethylbutanoate CAS Name: 2,2-dimethylbutanoic acid 2-[3-(1,3-dihydrobenzotriazol-2-yl)-4-hydroxyphenyl]ethyl ester IUPAC Name: 2-[3-(1,3-dihydrobenzotriazol-2-yl)-4-hydroxyphenyl]ethyl 2,2-dimethylbutanoate Traditional Name: 2,2-dimethylbutyric acid 2-[3-(1,3-dihydrobenzotriazol-2-yl)-4-hydroxy-phenyl]ethyl ester Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)OCCC1=CC(=C(C=C1)O)N2NC3=CC=CC=C3N2

Isomeric SMILES

CCC(C)(C)C(=O)OCCC1=CC(=C(C=C1)O)N2NC3=CC=CC=C3N2

InChI

InChI=1S/C20H25N3O3/c1-4-20(2,3)19(25)26-12-11-14-9-10-18(24)17(13-14)23-21-15-7-5-6-8-16(15)22-23/h5-10,13,21-22,24H,4,11-12H2,1-3H3