3-[2-(dihydroxyboranyl)-2-[(2-methoxyphenyl)carbonylamino]ethyl]-2-oxidanyl-benzoic acid

Systemtic Name: 3-[2-(dihydroxyboranyl)-2-[(2-methoxyphenyl)carbonylamino]ethyl]-2-oxidanyl-benzoic acid Openeye Name: 3-[2-borono-2-[(2-methoxybenzoyl)amino]ethyl]-2-hydroxy-benzoic acid CAS Name: 3-[2-borono-2-[[(2-methoxyphenyl)-oxomethyl]amino]ethyl]-2-hydroxybenzoic acid IUPAC Name: 3-[2-borono-2-[(2-methoxybenzoyl)amino]ethyl]-2-hydroxybenzoic acid Traditional Name: 3-[2-borono-2-(o-anisoylamino)ethyl]-2-hydroxy-benzoic acid Formula: C17H18BNO7 MolecularWeight: 359.13832

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Descriptors Computed from Structure

Canonical SMILES:

B(C(CC1=CC=CC(=C1O)C(=O)O)NC(=O)C2=CC=CC=C2OC)(O)O

Isomeric SMILES

B(C(CC1=CC=CC(=C1O)C(=O)O)NC(=O)C2=CC=CC=C2OC)(O)O

InChI

InChI=1S/C17H18BNO7/c1-26-13-8-3-2-6-11(13)16(21)19-14(18(24)25)9-10-5-4-7-12(15(10)20)17(22)23/h2-8,14,20,24-25H,9H2,1H3,(H,19,21)(H,22,23)