(1-azanyl-3-methyl-butyl)boronic acid; 3-phenyl-2-(1H-pyrrol-2-ylcarbonylamino)propanoic acid

Systemtic Name: (1-azanyl-3-methyl-butyl)boronic acid; 3-phenyl-2-(1H-pyrrol-2-ylcarbonylamino)propanoic acid Openeye Name: (1-amino-3-methyl-butyl)boronic acid; 3-phenyl-2-(1H-pyrrole-2-carbonylamino)propanoic acid CAS Name: (1-amino-3-methylbutyl)boronic acid; 2-[[oxo(1H-pyrrol-2-yl)methyl]amino]-3-phenylpropanoic acid IUPAC Name: (1-amino-3-methylbutyl)boronic acid; 3-phenyl-2-(1H-pyrrole-2-carbonylamino)propanoic acid Traditional Name: (1-amino-3-methyl-butyl)boronic acid; 3-phenyl-2-(1H-pyrrole-2-carbonylamino)propionic acid Formula: C19H28BN3O5 MolecularWeight: 389.25372

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Descriptors Computed from Structure

Canonical SMILES:

B(C(CC(C)C)N)(O)O.C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2=CC=CN2

Isomeric SMILES

B(C(CC(C)C)N)(O)O.C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2=CC=CN2

InChI

InChI=1S/C14H14N2O3.C5H14BNO2/c17-13(11-7-4-8-15-11)16-12(14(18)19)9-10-5-2-1-3-6-10;1-4(2)3-5(7)6(8)9/h1-8,12,15H,9H2,(H,16,17)(H,18,19);4-5,8-9H,3,7H2,1-2H3