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1-oxidanyl-3-(phenylmethyl)-2,4,1-benzoxazaborinine-7-carboxylic acid

1-oxidanyl-3-(phenylmethyl)-2,4,1-benzoxazaborinine-7-carboxylic acid

Systemtic Name:1-oxidanyl-3-(phenylmethyl)-2,4,1-benzoxazaborinine-7-carboxylic acid
Openeye Name:3-benzyl-1-hydroxy-2,4,1-benzoxazaborinine-7-carboxylic acid
CAS Name:1-hydroxy-3-(phenylmethyl)-2,4,1-benzoxazaborine-7-carboxylic acid
IUPAC Name:3-benzyl-1-hydroxy-2,4,1-benzoxazaborinine-7-carboxylic acid
Traditional Name:3-benzyl-1-hydroxy-2,4,1-benzoxazaborine-7-carboxylic acid
Formula: C15H12BNO4
MolecularWeight: 281.07108
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Descriptors Computed from Structure

Canonical SMILES:

B1(C2=C(C=CC(=C2)C(=O)O)N=C(O1)CC3=CC=CC=C3)O


Isomeric SMILES

B1(C2=C(C=CC(=C2)C(=O)O)N=C(O1)CC3=CC=CC=C3)O


InChI

InChI=1S/C15H12BNO4/c18-15(19)11-6-7-13-12(9-11)16(20)21-14(17-13)8-10-4-2-1-3-5-10/h1-7,9,20H,8H2,(H,18,19)


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