methyl 3-[3-tert-butyl-4-oxidanyl-5-[4-(trifluoromethyl)benzotriazol-2-yl]phenyl]propanoate

Systemtic Name: methyl 3-[3-tert-butyl-4-oxidanyl-5-[4-(trifluoromethyl)benzotriazol-2-yl]phenyl]propanoate Openeye Name: methyl 3-[3-tert-butyl-4-hydroxy-5-[4-(trifluoromethyl)benzotriazol-2-yl]phenyl]propanoate CAS Name: 3-[3-tert-butyl-4-hydroxy-5-[4-(trifluoromethyl)-2-benzotriazolyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-tert-butyl-4-hydroxy-5-[4-(trifluoromethyl)benzotriazol-2-yl]phenyl]propanoate Traditional Name: 3-[3-tert-butyl-4-hydroxy-5-[4-(trifluoromethyl)benzotriazol-2-yl]phenyl]propionic acid methyl ester Formula: C21H22F3N3O3 MolecularWeight: 421.41289

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC(=C1)CCC(=O)OC)N2N=C3C=CC=C(C3=N2)C(F)(F)F)O

Isomeric SMILES

CC(C)(C)C1=C(C(=CC(=C1)CCC(=O)OC)N2N=C3C=CC=C(C3=N2)C(F)(F)F)O

InChI

InChI=1S/C21H22F3N3O3/c1-20(2,3)14-10-12(8-9-17(28)30-4)11-16(19(14)29)27-25-15-7-5-6-13(18(15)26-27)21(22,23)24/h5-7,10-11,29H,8-9H2,1-4H3