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

Systemtic Name: octyl 3-[3-tert-butyl-4-oxidanyl-5-(5-phenylsulfanylbenzotriazol-2-yl)phenyl]propanoate Openeye Name: octyl 3-[3-tert-butyl-4-hydroxy-5-(5-phenylsulfanylbenzotriazol-2-yl)phenyl]propanoate CAS Name: 3-[3-tert-butyl-4-hydroxy-5-[5-(phenylthio)-2-benzotriazolyl]phenyl]propanoic acid octyl ester IUPAC Name: octyl 3-[3-tert-butyl-4-hydroxy-5-(5-phenylsulfanylbenzotriazol-2-yl)phenyl]propanoate Traditional Name: 3-[3-tert-butyl-4-hydroxy-5-[5-(phenylthio)benzotriazol-2-yl]phenyl]propionic acid octyl ester Formula: C33H41N3O3S MolecularWeight: 559.76194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CCC1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)SC4=CC=CC=C4)O)C(C)(C)C

Isomeric SMILES

CCCCCCCCOC(=O)CCC1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)SC4=CC=CC=C4)O)C(C)(C)C

InChI

InChI=1S/C33H41N3O3S/c1-5-6-7-8-9-13-20-39-31(37)19-16-24-21-27(33(2,3)4)32(38)30(22-24)36-34-28-18-17-26(23-29(28)35-36)40-25-14-11-10-12-15-25/h10-12,14-15,17-18,21-23,38H,5-9,13,16,19-20H2,1-4H3