2-[(2-azanyl-4-methyl-pentanoyl)oxy-morpholin-4-ylcarbonyl-amino]-3-phenyl-propanoic acid; boric acid

Systemtic Name: 2-[(2-azanyl-4-methyl-pentanoyl)oxy-morpholin-4-ylcarbonyl-amino]-3-phenyl-propanoic acid; boric acid Openeye Name: 2-[(2-amino-4-methyl-pentanoyl)oxy-(morpholine-4-carbonyl)amino]-3-phenyl-propanoic acid; boric acid CAS Name: 2-[(2-amino-4-methyl-1-oxopentoxy)-[4-morpholinyl(oxo)methyl]amino]-3-phenylpropanoic acid; boric acid IUPAC Name: 2-[(2-amino-4-methylpentanoyl)oxy-(morpholine-4-carbonyl)amino]-3-phenylpropanoic acid; boric acid Traditional Name: 2-[(2-amino-4-methyl-pentanoyl)oxy-(morpholine-4-carbonyl)amino]-3-phenyl-propionic acid; boric acid Formula: C20H32BN3O9 MolecularWeight: 469.29378

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Descriptors Computed from Structure

Canonical SMILES:

B(O)(O)O.CC(C)CC(C(=O)ON(C(CC1=CC=CC=C1)C(=O)O)C(=O)N2CCOCC2)N

Isomeric SMILES

B(O)(O)O.CC(C)CC(C(=O)ON(C(CC1=CC=CC=C1)C(=O)O)C(=O)N2CCOCC2)N

InChI

InChI=1S/C20H29N3O6.BH3O3/c1-14(2)12-16(21)19(26)29-23(20(27)22-8-10-28-11-9-22)17(18(24)25)13-15-6-4-3-5-7-15;2-1(3)4/h3-7,14,16-17H,8-13,21H2,1-2H3,(H,24,25);2-4H