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

Systemtic Name: octyl 3-[3-tert-butyl-5-(4-chloranylbenzotriazol-2-yl)-4-oxidanyl-phenyl]propanoate Openeye Name: octyl 3-[3-tert-butyl-5-(4-chlorobenzotriazol-2-yl)-4-hydroxy-phenyl]propanoate CAS Name: 3-[3-tert-butyl-5-(4-chloro-2-benzotriazolyl)-4-hydroxyphenyl]propanoic acid octyl ester IUPAC Name: octyl 3-[3-tert-butyl-5-(4-chlorobenzotriazol-2-yl)-4-hydroxyphenyl]propanoate Traditional Name: 3-[3-tert-butyl-5-(4-chlorobenzotriazol-2-yl)-4-hydroxy-phenyl]propionic acid octyl ester Formula: C27H36ClN3O3 MolecularWeight: 486.04604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CCC1=CC(=C(C(=C1)N2N=C3C=CC=C(C3=N2)Cl)O)C(C)(C)C

Isomeric SMILES

CCCCCCCCOC(=O)CCC1=CC(=C(C(=C1)N2N=C3C=CC=C(C3=N2)Cl)O)C(C)(C)C

InChI

InChI=1S/C27H36ClN3O3/c1-5-6-7-8-9-10-16-34-24(32)15-14-19-17-20(27(2,3)4)26(33)23(18-19)31-29-22-13-11-12-21(28)25(22)30-31/h11-13,17-18,33H,5-10,14-16H2,1-4H3