[3-[[1-(cyclohexylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-ethanoyl-amino]-5-(propan-2-ylcarbamoyl)phenyl]boronic acid

Systemtic Name: [3-[[1-(cyclohexylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-ethanoyl-amino]-5-(propan-2-ylcarbamoyl)phenyl]boronic acid Openeye Name: [3-[acetyl-[1-(cyclohexylcarbamoyl)-2-methyl-propyl]amino]-5-(isopropylcarbamoyl)phenyl]boronic acid CAS Name: [3-[acetyl-[1-(cyclohexylamino)-3-methyl-1-oxobutan-2-yl]amino]-5-[oxo-(propan-2-ylamino)methyl]phenyl]boronic acid IUPAC Name: [3-[acetyl-[1-(cyclohexylamino)-3-methyl-1-oxobutan-2-yl]amino]-5-(propan-2-ylcarbamoyl)phenyl]boronic acid Traditional Name: [3-[acetyl-[1-(cyclohexylcarbamoyl)-2-methyl-propyl]amino]-5-(isopropylcarbamoyl)phenyl]boronic acid Formula: C23H36BN3O5 MolecularWeight: 445.36004

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=CC(=C1)N(C(C(C)C)C(=O)NC2CCCCC2)C(=O)C)C(=O)NC(C)C)(O)O

Isomeric SMILES

B(C1=CC(=CC(=C1)N(C(C(C)C)C(=O)NC2CCCCC2)C(=O)C)C(=O)NC(C)C)(O)O

InChI

InChI=1S/C23H36BN3O5/c1-14(2)21(23(30)26-19-9-7-6-8-10-19)27(16(5)28)20-12-17(22(29)25-15(3)4)11-18(13-20)24(31)32/h11-15,19,21,31-32H,6-10H2,1-5H3,(H,25,29)(H,26,30)