(3-ethoxycarbonyl-4-oxidanylidene-7,8-dihydrocyclohepta[b]pyrrol-1-yl)-methyl-borinic acid

Systemtic Name: (3-ethoxycarbonyl-4-oxidanylidene-7,8-dihydrocyclohepta[b]pyrrol-1-yl)-methyl-borinic acid Openeye Name: (3-ethoxycarbonyl-4-oxo-7,8-dihydrocyclohepta[b]pyrrol-1-yl)-methyl-borinic acid CAS Name: (3-ethoxycarbonyl-4-oxo-7,8-dihydrocyclohepta[b]pyrrol-1-yl)-methylborinic acid IUPAC Name: (3-ethoxycarbonyl-4-oxo-7,8-dihydrocyclohepta[b]pyrrol-1-yl)-methylborinic acid Traditional Name: (3-carbethoxy-4-keto-7,8-dihydrocyclohepta[b]pyrrol-1-yl)-methyl-borinic acid Formula: C13H16BNO4 MolecularWeight: 261.08144

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Descriptors Computed from Structure

Canonical SMILES:

B(C)(N1C=C(C2=C1CCC=CC2=O)C(=O)OCC)O

Isomeric SMILES

B(C)(N1C=C(C2=C1CCC=CC2=O)C(=O)OCC)O

InChI

InChI=1S/C13H16BNO4/c1-3-19-13(17)9-8-15(14(2)18)10-6-4-5-7-11(16)12(9)10/h5,7-8,18H,3-4,6H2,1-2H3