2-azanyl-4-methyl-pentanoic acid; boric acid; 2-(morpholin-4-ylcarbonylamino)-3-phenyl-propanoic acid

Systemtic Name: 2-azanyl-4-methyl-pentanoic acid; boric acid; 2-(morpholin-4-ylcarbonylamino)-3-phenyl-propanoic acid Openeye Name: 2-amino-4-methyl-pentanoic acid; boric acid; 2-(morpholine-4-carbonylamino)-3-phenyl-propanoic acid CAS Name: 2-amino-4-methylpentanoic acid; boric acid; 2-[[4-morpholinyl(oxo)methyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-amino-4-methylpentanoic acid; boric acid; 2-(morpholine-4-carbonylamino)-3-phenylpropanoic acid Traditional Name: 2-amino-4-methyl-valeric acid; boric acid; 2-(morpholine-4-carbonylamino)-3-phenyl-propionic acid Formula: C20H34BN3O9 MolecularWeight: 471.30966

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Descriptors Computed from Structure

Canonical SMILES:

B(O)(O)O.CC(C)CC(C(=O)O)N.C1COCCN1C(=O)NC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

B(O)(O)O.CC(C)CC(C(=O)O)N.C1COCCN1C(=O)NC(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C14H18N2O4.C6H13NO2.BH3O3/c17-13(18)12(10-11-4-2-1-3-5-11)15-14(19)16-6-8-20-9-7-16;1-4(2)3-5(7)6(8)9;2-1(3)4/h1-5,12H,6-10H2,(H,15,19)(H,17,18);4-5H,3,7H2,1-2H3,(H,8,9);2-4H