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

Systemtic Name: (3-tert-butyl-2-ethyl-hexyl) 2-[3-(5-chloranylbenzotriazol-2-yl)phenyl]-3-oxidanyl-propanoate Openeye Name: (3-tert-butyl-2-ethyl-hexyl) 2-[3-(5-chlorobenzotriazol-2-yl)phenyl]-3-hydroxy-propanoate CAS Name: 2-[3-(5-chloro-2-benzotriazolyl)phenyl]-3-hydroxypropanoic acid (3-tert-butyl-2-ethylhexyl) ester IUPAC Name: (3-tert-butyl-2-ethylhexyl) 2-[3-(5-chlorobenzotriazol-2-yl)phenyl]-3-hydroxypropanoate Traditional Name: 2-[3-(5-chlorobenzotriazol-2-yl)phenyl]-3-hydroxy-propionic acid (3-tert-butyl-2-ethyl-hexyl) ester Formula: C27H36ClN3O3 MolecularWeight: 486.04604

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)COC(=O)C(CO)C1=CC(=CC=C1)N2N=C3C=CC(=CC3=N2)Cl)C(C)(C)C

Isomeric SMILES

CCCC(C(CC)COC(=O)C(CO)C1=CC(=CC=C1)N2N=C3C=CC(=CC3=N2)Cl)C(C)(C)C

InChI

InChI=1S/C27H36ClN3O3/c1-6-9-23(27(3,4)5)18(7-2)17-34-26(33)22(16-32)19-10-8-11-21(14-19)31-29-24-13-12-20(28)15-25(24)30-31/h8,10-15,18,22-23,32H,6-7,9,16-17H2,1-5H3