[3-methyl-1-[[3-phenyl-2-(3-phenylpropanoylamino)propanoyl]amino]butyl]boronic acid

Systemtic Name: [3-methyl-1-[[3-phenyl-2-(3-phenylpropanoylamino)propanoyl]amino]butyl]boronic acid Openeye Name: [3-methyl-1-[[3-phenyl-2-(3-phenylpropanoylamino)propanoyl]amino]butyl]boronic acid CAS Name: [3-methyl-1-[[1-oxo-2-[(1-oxo-3-phenylpropyl)amino]-3-phenylpropyl]amino]butyl]boronic acid IUPAC Name: [3-methyl-1-[[3-phenyl-2-(3-phenylpropanoylamino)propanoyl]amino]butyl]boronic acid Traditional Name: [1-[[2-(hydrocinnamoylamino)-3-phenyl-propanoyl]amino]-3-methyl-butyl]boronic acid Formula: C23H31BN2O4 MolecularWeight: 410.31424

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Descriptors Computed from Structure

Canonical SMILES:

B(C(CC(C)C)NC(=O)C(CC1=CC=CC=C1)NC(=O)CCC2=CC=CC=C2)(O)O

Isomeric SMILES

B(C(CC(C)C)NC(=O)C(CC1=CC=CC=C1)NC(=O)CCC2=CC=CC=C2)(O)O

InChI

InChI=1S/C23H31BN2O4/c1-17(2)15-21(24(29)30)26-23(28)20(16-19-11-7-4-8-12-19)25-22(27)14-13-18-9-5-3-6-10-18/h3-12,17,20-21,29-30H,13-16H2,1-2H3,(H,25,27)(H,26,28)