5-[3-(benzotriazol-2-yl)-5-tert-butyl-4-oxidanyl-phenyl]pentanoic acid

Systemtic Name: 5-[3-(benzotriazol-2-yl)-5-tert-butyl-4-oxidanyl-phenyl]pentanoic acid Openeye Name: 5-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxy-phenyl]pentanoic acid CAS Name: 5-[3-(2-benzotriazolyl)-5-tert-butyl-4-hydroxyphenyl]pentanoic acid IUPAC Name: 5-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]pentanoic acid Traditional Name: 5-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxy-phenyl]valeric acid Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC(=C1)CCCCC(=O)O)N2N=C3C=CC=CC3=N2)O

Isomeric SMILES

CC(C)(C)C1=C(C(=CC(=C1)CCCCC(=O)O)N2N=C3C=CC=CC3=N2)O

InChI

InChI=1S/C21H25N3O3/c1-21(2,3)15-12-14(8-4-7-11-19(25)26)13-18(20(15)27)24-22-16-9-5-6-10-17(16)23-24/h5-6,9-10,12-13,27H,4,7-8,11H2,1-3H3,(H,25,26)