methyl 3-[3-tert-butyl-5-(5-chloranylbenzotriazol-2-yl)phenyl]-2-oxidanyl-propanoate

Systemtic Name: methyl 3-[3-tert-butyl-5-(5-chloranylbenzotriazol-2-yl)phenyl]-2-oxidanyl-propanoate Openeye Name: methyl 3-[3-tert-butyl-5-(5-chlorobenzotriazol-2-yl)phenyl]-2-hydroxy-propanoate CAS Name: 3-[3-tert-butyl-5-(5-chloro-2-benzotriazolyl)phenyl]-2-hydroxypropanoic acid methyl ester IUPAC Name: methyl 3-[3-tert-butyl-5-(5-chlorobenzotriazol-2-yl)phenyl]-2-hydroxypropanoate Traditional Name: 3-[3-tert-butyl-5-(5-chlorobenzotriazol-2-yl)phenyl]-2-hydroxy-propionic acid methyl ester Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)CC(C(=O)OC)O)N2N=C3C=CC(=CC3=N2)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)CC(C(=O)OC)O)N2N=C3C=CC(=CC3=N2)Cl

InChI

InChI=1S/C20H22ClN3O3/c1-20(2,3)13-7-12(9-18(25)19(26)27-4)8-15(10-13)24-22-16-6-5-14(21)11-17(16)23-24/h5-8,10-11,18,25H,9H2,1-4H3