[3-tert-butyl-5-(5-iodanylbenzotriazol-2-yl)-4-oxidanyl-phenyl]methyl 2-methylprop-2-enoate

Systemtic Name: [3-tert-butyl-5-(5-iodanylbenzotriazol-2-yl)-4-oxidanyl-phenyl]methyl 2-methylprop-2-enoate Openeye Name: [3-tert-butyl-4-hydroxy-5-(5-iodobenzotriazol-2-yl)phenyl]methyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid [3-tert-butyl-4-hydroxy-5-(5-iodo-2-benzotriazolyl)phenyl]methyl ester IUPAC Name: [3-tert-butyl-4-hydroxy-5-(5-iodobenzotriazol-2-yl)phenyl]methyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid [3-tert-butyl-4-hydroxy-5-(5-iodobenzotriazol-2-yl)benzyl] ester Formula: C21H22IN3O3 MolecularWeight: 491.32215

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OCC1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)I)O)C(C)(C)C

Isomeric SMILES

CC(=C)C(=O)OCC1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)I)O)C(C)(C)C

InChI

InChI=1S/C21H22IN3O3/c1-12(2)20(27)28-11-13-8-15(21(3,4)5)19(26)18(9-13)25-23-16-7-6-14(22)10-17(16)24-25/h6-10,26H,1,11H2,2-5H3