methyl 1-oxidanyl-3-(thiophen-2-ylmethyl)-2,4,1-benzoxazaborinine-7-carboxylate

Systemtic Name: methyl 1-oxidanyl-3-(thiophen-2-ylmethyl)-2,4,1-benzoxazaborinine-7-carboxylate Openeye Name: methyl 1-hydroxy-3-(2-thienylmethyl)-2,4,1-benzoxazaborinine-7-carboxylate CAS Name: 1-hydroxy-3-(thiophen-2-ylmethyl)-2,4,1-benzoxazaborine-7-carboxylic acid methyl ester IUPAC Name: methyl 1-hydroxy-3-(thiophen-2-ylmethyl)-2,4,1-benzoxazaborinine-7-carboxylate Traditional Name: 1-hydroxy-3-(2-thenyl)-2,4,1-benzoxazaborine-7-carboxylic acid methyl ester Formula: C14H12BNO4S MolecularWeight: 301.12538

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Descriptors Computed from Structure

Canonical SMILES:

B1(C2=C(C=CC(=C2)C(=O)OC)N=C(O1)CC3=CC=CS3)O

Isomeric SMILES

B1(C2=C(C=CC(=C2)C(=O)OC)N=C(O1)CC3=CC=CS3)O

InChI

InChI=1S/C14H12BNO4S/c1-19-14(17)9-4-5-12-11(7-9)15(18)20-13(16-12)8-10-3-2-6-21-10/h2-7,18H,8H2,1H3