2-(3-tert-butyl-4-oxidanyl-phenyl)-3-(5-chloranylbenzotriazol-2-yl)propanoic acid

Systemtic Name: 2-(3-tert-butyl-4-oxidanyl-phenyl)-3-(5-chloranylbenzotriazol-2-yl)propanoic acid Openeye Name: 2-(3-tert-butyl-4-hydroxy-phenyl)-3-(5-chlorobenzotriazol-2-yl)propanoic acid CAS Name: 2-(3-tert-butyl-4-hydroxyphenyl)-3-(5-chloro-2-benzotriazolyl)propanoic acid IUPAC Name: 2-(3-tert-butyl-4-hydroxyphenyl)-3-(5-chlorobenzotriazol-2-yl)propanoic acid Traditional Name: 2-(3-tert-butyl-4-hydroxy-phenyl)-3-(5-chlorobenzotriazol-2-yl)propionic acid Formula: C19H20ClN3O3 MolecularWeight: 373.8334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)C(CN2N=C3C=CC(=CC3=N2)Cl)C(=O)O)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)C(CN2N=C3C=CC(=CC3=N2)Cl)C(=O)O)O

InChI

InChI=1S/C19H20ClN3O3/c1-19(2,3)14-8-11(4-7-17(14)24)13(18(25)26)10-23-21-15-6-5-12(20)9-16(15)22-23/h4-9,13,24H,10H2,1-3H3,(H,25,26)