octyl 3-[3-(5-chloranylbenzotriazol-2-yl)-5-(1,1-diphenylethyl)-4-oxidanyl-phenyl]propanoate

Systemtic Name: octyl 3-[3-(5-chloranylbenzotriazol-2-yl)-5-(1,1-diphenylethyl)-4-oxidanyl-phenyl]propanoate Openeye Name: octyl 3-[3-(5-chlorobenzotriazol-2-yl)-5-(1,1-diphenylethyl)-4-hydroxy-phenyl]propanoate CAS Name: 3-[3-(5-chloro-2-benzotriazolyl)-5-(1,1-diphenylethyl)-4-hydroxyphenyl]propanoic acid octyl ester IUPAC Name: octyl 3-[3-(5-chlorobenzotriazol-2-yl)-5-(1,1-diphenylethyl)-4-hydroxyphenyl]propanoate Traditional Name: 3-[3-(5-chlorobenzotriazol-2-yl)-5-(1,1-diphenylethyl)-4-hydroxy-phenyl]propionic acid octyl ester Formula: C37H40ClN3O3 MolecularWeight: 610.1848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CCC1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)Cl)O)C(C)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCCCCCOC(=O)CCC1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)Cl)O)C(C)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C37H40ClN3O3/c1-3-4-5-6-7-14-23-44-35(42)22-19-27-24-31(37(2,28-15-10-8-11-16-28)29-17-12-9-13-18-29)36(43)34(25-27)41-39-32-21-20-30(38)26-33(32)40-41/h8-13,15-18,20-21,24-26,43H,3-7,14,19,22-23H2,1-2H3