3,5,5-trimethylhexyl 4-[(6-methyl-4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl]benzoate

Systemtic Name: 3,5,5-trimethylhexyl 4-[(6-methyl-4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl]benzoate Openeye Name: 3,5,5-trimethylhexyl 4-[(6-methyl-4-oxo-1,2,3-benzotriazin-3-yl)methyl]benzoate CAS Name: 4-[(6-methyl-4-oxo-1,2,3-benzotriazin-3-yl)methyl]benzoic acid 3,5,5-trimethylhexyl ester IUPAC Name: 3,5,5-trimethylhexyl 4-[(6-methyl-4-oxo-1,2,3-benzotriazin-3-yl)methyl]benzoate Traditional Name: 4-[(4-keto-6-methyl-1,2,3-benzotriazin-3-yl)methyl]benzoic acid 3,5,5-trimethylhexyl ester Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=NN(C2=O)CC3=CC=C(C=C3)C(=O)OCCC(C)CC(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=NN(C2=O)CC3=CC=C(C=C3)C(=O)OCCC(C)CC(C)(C)C

InChI

InChI=1S/C25H31N3O3/c1-17-6-11-22-21(14-17)23(29)28(27-26-22)16-19-7-9-20(10-8-19)24(30)31-13-12-18(2)15-25(3,4)5/h6-11,14,18H,12-13,15-16H2,1-5H3