N-(2-isocyanoethyl)-methyl-N-[3-[3-(methylamino)propyl-[methyl(oxidanyl)boranyl]amino]propyl]boronamidic acid

Systemtic Name: N-(2-isocyanoethyl)-methyl-N-[3-[3-(methylamino)propyl-[methyl(oxidanyl)boranyl]amino]propyl]boronamidic acid Openeye Name: N-[3-[[hydroxy(methyl)boranyl]-(2-isocyanoethyl)amino]propyl]-methyl-N-[3-(methylamino)propyl]boronamidic acid CAS Name: N-[3-[[hydroxy(methyl)boranyl]-(2-isocyanoethyl)amino]propyl]-methyl-N-[3-(methylamino)propyl]boronamidic acid IUPAC Name: N-[3-[[hydroxy(methyl)boranyl]-(2-isocyanoethyl)amino]propyl]-methyl-N-[3-(methylamino)propyl]boronamidic acid Traditional Name: N-[3-[[hydroxy(methyl)boranyl]-(2-isocyanoethyl)amino]propyl]-methyl-N-[3-(methylamino)propyl]boronamidic acid Formula: C12H28B2N4O2 MolecularWeight: 281.99832

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Descriptors Computed from Structure

Canonical SMILES:

B(C)(N(CCCNC)CCCN(B(C)O)CC[N+]#[C-])O

Isomeric SMILES

B(C)(N(CCCNC)CCCN(B(C)O)CC[N+]#[C-])O

InChI

InChI=1S/C12H28B2N4O2/c1-13(19)17(9-5-7-15-3)10-6-11-18(14(2)20)12-8-16-4/h15,19-20H,5-12H2,1-3H3