3-[2-(dihydroxyboranyl)-2-[(4-methoxyphenyl)carbonylamino]ethyl]-2-oxidanyl-benzoic acid

Systemtic Name: 3-[2-(dihydroxyboranyl)-2-[(4-methoxyphenyl)carbonylamino]ethyl]-2-oxidanyl-benzoic acid Openeye Name: 3-[2-borono-2-[(4-methoxybenzoyl)amino]ethyl]-2-hydroxy-benzoic acid CAS Name: 3-[2-borono-2-[[(4-methoxyphenyl)-oxomethyl]amino]ethyl]-2-hydroxybenzoic acid IUPAC Name: 3-[2-borono-2-[(4-methoxybenzoyl)amino]ethyl]-2-hydroxybenzoic acid Traditional Name: 3-[2-borono-2-(p-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=C(C=C2)OC)(O)O

Isomeric SMILES

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

InChI

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