1-[[2-(3-azanyl-2-oxidanylidene-3-propan-2-yl-piperidin-1-yl)-2-phenyl-ethanoyl]amino]propylboronic acid

Systemtic Name: 1-[[2-(3-azanyl-2-oxidanylidene-3-propan-2-yl-piperidin-1-yl)-2-phenyl-ethanoyl]amino]propylboronic acid Openeye Name: 1-[[2-(3-amino-3-isopropyl-2-oxo-1-piperidyl)-2-phenyl-acetyl]amino]propylboronic acid CAS Name: 1-[[2-(3-amino-2-oxo-3-propan-2-yl-1-piperidinyl)-1-oxo-2-phenylethyl]amino]propylboronic acid IUPAC Name: 1-[[2-(3-amino-2-oxo-3-propan-2-ylpiperidin-1-yl)-2-phenylacetyl]amino]propylboronic acid Traditional Name: 1-[[2-(3-amino-3-isopropyl-2-keto-piperidino)-2-phenyl-acetyl]amino]propylboronic acid Formula: C19H30BN3O4 MolecularWeight: 375.2702

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Descriptors Computed from Structure

Canonical SMILES:

B(C(CC)NC(=O)C(C1=CC=CC=C1)N2CCCC(C2=O)(C(C)C)N)(O)O

Isomeric SMILES

B(C(CC)NC(=O)C(C1=CC=CC=C1)N2CCCC(C2=O)(C(C)C)N)(O)O

InChI

InChI=1S/C19H30BN3O4/c1-4-15(20(26)27)22-17(24)16(14-9-6-5-7-10-14)23-12-8-11-19(21,13(2)3)18(23)25/h5-7,9-10,13,15-16,26-27H,4,8,11-12,21H2,1-3H3,(H,22,24)