4-(bromomethyl)-7-methoxy-chromen-2-one; 4-(dihydroxyboranyl)benzoic acid

Systemtic Name: 4-(bromomethyl)-7-methoxy-chromen-2-one; 4-(dihydroxyboranyl)benzoic acid Openeye Name: 4-boronobenzoic acid; 4-(bromomethyl)-7-methoxy-chromen-2-one CAS Name: 4-boronobenzoic acid; 4-(bromomethyl)-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-boronobenzoic acid; 4-(bromomethyl)-7-methoxychromen-2-one Traditional Name: 4-boronobenzoic acid; 4-(bromomethyl)-7-methoxy-coumarin Formula: C18H16BBrO7 MolecularWeight: 435.03044

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)C(=O)O)(O)O.COC1=CC2=C(C=C1)C(=CC(=O)O2)CBr

Isomeric SMILES

B(C1=CC=C(C=C1)C(=O)O)(O)O.COC1=CC2=C(C=C1)C(=CC(=O)O2)CBr

InChI

InChI=1S/C11H9BrO3.C7H7BO4/c1-14-8-2-3-9-7(6-12)4-11(13)15-10(9)5-8;9-7(10)5-1-3-6(4-2-5)8(11)12/h2-5H,6H2,1H3;1-4,11-12H,(H,9,10)