3-[2-(dihydroxyboranyl)-2-(pyrrolidin-2-ylcarbonylamino)ethyl]-2-oxidanyl-benzoic acid

Systemtic Name: 3-[2-(dihydroxyboranyl)-2-(pyrrolidin-2-ylcarbonylamino)ethyl]-2-oxidanyl-benzoic acid Openeye Name: 3-[2-borono-2-(pyrrolidine-2-carbonylamino)ethyl]-2-hydroxy-benzoic acid CAS Name: 3-[2-borono-2-[[oxo(2-pyrrolidinyl)methyl]amino]ethyl]-2-hydroxybenzoic acid IUPAC Name: 3-[2-borono-2-(pyrrolidine-2-carbonylamino)ethyl]-2-hydroxybenzoic acid Traditional Name: 3-[2-borono-2-(prolylamino)ethyl]-2-hydroxy-benzoic acid Formula: C14H19BN2O6 MolecularWeight: 322.12146

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Descriptors Computed from Structure

Canonical SMILES:

B(C(CC1=CC=CC(=C1O)C(=O)O)NC(=O)C2CCCN2)(O)O

Isomeric SMILES

B(C(CC1=CC=CC(=C1O)C(=O)O)NC(=O)C2CCCN2)(O)O

InChI

InChI=1S/C14H19BN2O6/c18-12-8(3-1-4-9(12)14(20)21)7-11(15(22)23)17-13(19)10-5-2-6-16-10/h1,3-4,10-11,16,18,22-23H,2,5-7H2,(H,17,19)(H,20,21)