[1-tert-butylimino-1-oxidanidyl-3-[4-(phenylcarbonyloxy)phenyl]propan-2-yl]iminomethoxyboron

Systemtic Name: [1-tert-butylimino-1-oxidanidyl-3-[4-(phenylcarbonyloxy)phenyl]propan-2-yl]iminomethoxyboron Openeye Name: [1-[(4-benzoyloxyphenyl)methyl]-2-tert-butylimino-2-oxido-ethyl]iminomethoxyboron CAS Name: [3-(4-benzoyloxyphenyl)-1-tert-butylimino-1-oxidopropan-2-yl]iminomethoxyboron IUPAC Name: [3-(4-benzoyloxyphenyl)-1-tert-butylimino-1-oxidopropan-2-yl]iminomethoxyboron Traditional Name: [1-(4-benzoyloxybenzyl)-2-tert-butylimino-2-oxido-ethyl]iminomethoxyboron Formula: C21H22BN2O4- MolecularWeight: 377.22138

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Descriptors Computed from Structure

Canonical SMILES:

[B]OC=NC(CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2)C(=NC(C)(C)C)[O-]

Isomeric SMILES

[B]OC=NC(CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2)C(=NC(C)(C)C)[O-]

InChI

InChI=1S/C21H23BN2O4/c1-21(2,3)24-19(25)18(23-14-27-22)13-15-9-11-17(12-10-15)28-20(26)16-7-5-4-6-8-16/h4-12,14,18H,13H2,1-3H3,(H,24,25)/p-1