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

Systemtic Name: octyl 3-[4-(3-tert-butyl-2-oxidanyl-phenyl)-3-(5-chloranylbenzotriazol-2-yl)phenyl]propanoate Openeye Name: octyl 3-[4-(3-tert-butyl-2-hydroxy-phenyl)-3-(5-chlorobenzotriazol-2-yl)phenyl]propanoate CAS Name: 3-[4-(3-tert-butyl-2-hydroxyphenyl)-3-(5-chloro-2-benzotriazolyl)phenyl]propanoic acid octyl ester IUPAC Name: octyl 3-[4-(3-tert-butyl-2-hydroxyphenyl)-3-(5-chlorobenzotriazol-2-yl)phenyl]propanoate Traditional Name: 3-[4-(3-tert-butyl-2-hydroxy-phenyl)-3-(5-chlorobenzotriazol-2-yl)phenyl]propionic acid octyl ester Formula: C33H40ClN3O3 MolecularWeight: 562.142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CCC1=CC(=C(C=C1)C2=C(C(=CC=C2)C(C)(C)C)O)N3N=C4C=CC(=CC4=N3)Cl

Isomeric SMILES

CCCCCCCCOC(=O)CCC1=CC(=C(C=C1)C2=C(C(=CC=C2)C(C)(C)C)O)N3N=C4C=CC(=CC4=N3)Cl

InChI

InChI=1S/C33H40ClN3O3/c1-5-6-7-8-9-10-20-40-31(38)19-15-23-14-17-25(26-12-11-13-27(32(26)39)33(2,3)4)30(21-23)37-35-28-18-16-24(34)22-29(28)36-37/h11-14,16-18,21-22,39H,5-10,15,19-20H2,1-4H3