octyl 5-[3-(benzotriazol-2-yl)-5-methyl-2-oxidanyl-phenyl]-5-methyl-hexanoate

Systemtic Name: octyl 5-[3-(benzotriazol-2-yl)-5-methyl-2-oxidanyl-phenyl]-5-methyl-hexanoate Openeye Name: octyl 5-[3-(benzotriazol-2-yl)-2-hydroxy-5-methyl-phenyl]-5-methyl-hexanoate CAS Name: 5-[3-(2-benzotriazolyl)-2-hydroxy-5-methylphenyl]-5-methylhexanoic acid octyl ester IUPAC Name: octyl 5-[3-(benzotriazol-2-yl)-2-hydroxy-5-methylphenyl]-5-methylhexanoate Traditional Name: 5-[3-(benzotriazol-2-yl)-2-hydroxy-5-methyl-phenyl]-5-methyl-hexanoic acid octyl ester Formula: C28H39N3O3 MolecularWeight: 465.62756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CCCC(C)(C)C1=C(C(=CC(=C1)C)N2N=C3C=CC=CC3=N2)O

Isomeric SMILES

CCCCCCCCOC(=O)CCCC(C)(C)C1=C(C(=CC(=C1)C)N2N=C3C=CC=CC3=N2)O

InChI

InChI=1S/C28H39N3O3/c1-5-6-7-8-9-12-18-34-26(32)16-13-17-28(3,4)22-19-21(2)20-25(27(22)33)31-29-23-14-10-11-15-24(23)30-31/h10-11,14-15,19-20,33H,5-9,12-13,16-18H2,1-4H3