4-[3-tert-butyl-5-(5-chloranylbenzotriazol-2-yl)-4-oxidanyl-phenyl]butanoate

Systemtic Name: 4-[3-tert-butyl-5-(5-chloranylbenzotriazol-2-yl)-4-oxidanyl-phenyl]butanoate Openeye Name: 4-[3-tert-butyl-5-(5-chlorobenzotriazol-2-yl)-4-hydroxy-phenyl]butanoate CAS Name: 4-[3-tert-butyl-5-(5-chloro-2-benzotriazolyl)-4-hydroxyphenyl]butanoate IUPAC Name: 4-[3-tert-butyl-5-(5-chlorobenzotriazol-2-yl)-4-hydroxyphenyl]butanoate Traditional Name: 4-[3-tert-butyl-5-(5-chlorobenzotriazol-2-yl)-4-hydroxy-phenyl]butyrate Formula: C20H21ClN3O3- MolecularWeight: 386.85204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC(=C1)CCCC(=O)[O-])N2N=C3C=CC(=CC3=N2)Cl)O

Isomeric SMILES

CC(C)(C)C1=C(C(=CC(=C1)CCCC(=O)[O-])N2N=C3C=CC(=CC3=N2)Cl)O

InChI

InChI=1S/C20H22ClN3O3/c1-20(2,3)14-9-12(5-4-6-18(25)26)10-17(19(14)27)24-22-15-8-7-13(21)11-16(15)23-24/h7-11,27H,4-6H2,1-3H3,(H,25,26)/p-1