[5-[(2-azanyl-6-methyl-3-nitro-phenyl)methyl]-2-tert-butyl-3-methyl-4-oxidanylidene-imidazolidin-1-yl]-methyl-borinic acid

Systemtic Name: [5-[(2-azanyl-6-methyl-3-nitro-phenyl)methyl]-2-tert-butyl-3-methyl-4-oxidanylidene-imidazolidin-1-yl]-methyl-borinic acid Openeye Name: [5-[(2-amino-6-methyl-3-nitro-phenyl)methyl]-2-tert-butyl-3-methyl-4-oxo-imidazolidin-1-yl]-methyl-borinic acid CAS Name: [5-[(2-amino-6-methyl-3-nitrophenyl)methyl]-2-tert-butyl-3-methyl-4-oxo-1-imidazolidinyl]-methylborinic acid IUPAC Name: [5-[(2-amino-6-methyl-3-nitrophenyl)methyl]-2-tert-butyl-3-methyl-4-oxoimidazolidin-1-yl]-methylborinic acid Traditional Name: [5-(2-amino-6-methyl-3-nitro-benzyl)-2-tert-butyl-4-keto-3-methyl-imidazolidin-1-yl]-methyl-borinic acid Formula: C17H27BN4O4 MolecularWeight: 362.23168

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Descriptors Computed from Structure

Canonical SMILES:

B(C)(N1C(C(=O)N(C1C(C)(C)C)C)CC2=C(C=CC(=C2N)[N+](=O)[O-])C)O

Isomeric SMILES

B(C)(N1C(C(=O)N(C1C(C)(C)C)C)CC2=C(C=CC(=C2N)[N+](=O)[O-])C)O

InChI

InChI=1S/C17H27BN4O4/c1-10-7-8-12(22(25)26)14(19)11(10)9-13-15(23)20(6)16(17(2,3)4)21(13)18(5)24/h7-8,13,16,24H,9,19H2,1-6H3