The molecular formula of the compound is C15H20BNO5.
What is the synonyms of the compound?
The synonyms of the compound are 944562-81-6, 1H-Indole-1-carboxylic acid, 2-borono-6-ethoxy-, 1-(1,1-dimethylethyl) ester, 2-borono-6-ethoxy-1H-indole-1-carboxylic acid-1-(1,1-dimethylethyl) ester, 1H-Indole-1-carboxylic acid,2-borono-6-ethoxy-,1-(1,1-dimethylethyl) ester, SCHEMBL12996827.
What is the molecular weight of the compound?
The molecular weight of the compound is 305.14 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is [6-ethoxy-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C15H20BNO5/c1-5-21-11-7-6-10-8-13(16(19)20)17(12(10)9-11)14(18)22-15(2,3)4/h6-9,19-20H,5H2,1-4H3.
What is the InChIKey of the compound?
The InChIKey of the compound is BDJBXIOGZZPJNN-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES of the compound is B(C1=CC2=C(N1C(=O)OC(C)(C)C)C=C(C=C2)OCC)(O)O.
What is the CAS number of the compound?
The CAS number of the compound is 944562-81-6.
What is the hydrogen bond donor count of the compound?
The hydrogen bond donor count of the compound is 2.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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