[3-(3-imidazol-1-ylpropylcarbamoyl)piperazin-1-yl]-methyl-borinic acid

Systemtic Name: [3-(3-imidazol-1-ylpropylcarbamoyl)piperazin-1-yl]-methyl-borinic acid Openeye Name: [3-(3-imidazol-1-ylpropylcarbamoyl)piperazin-1-yl]-methyl-borinic acid CAS Name: [3-[[3-(1-imidazolyl)propylamino]-oxomethyl]-1-piperazinyl]-methylborinic acid IUPAC Name: [3-(3-imidazol-1-ylpropylcarbamoyl)piperazin-1-yl]-methylborinic acid Traditional Name: [3-(3-imidazol-1-ylpropylcarbamoyl)piperazino]-methyl-borinic acid Formula: C12H22BN5O2 MolecularWeight: 279.14638

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Descriptors Computed from Structure

Canonical SMILES:

B(C)(N1CCNC(C1)C(=O)NCCCN2C=CN=C2)O

Isomeric SMILES

B(C)(N1CCNC(C1)C(=O)NCCCN2C=CN=C2)O

InChI

InChI=1S/C12H22BN5O2/c1-13(20)18-8-5-15-11(9-18)12(19)16-3-2-6-17-7-4-14-10-17/h4,7,10-11,15,20H,2-3,5-6,8-9H2,1H3,(H,16,19)