1-(1,1-Dimethylethyl) 2-borono-5-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-1H-indole-1-carboxylate

CAS Registry Number®

913388-61-1
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CAS Name

1-(1,1-Dimethylethyl) 2-borono-5-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-1H-indole-1-carboxylate

Molecular Formula

C20H30BN3O5

Molecular Mass

403.28

Cite this Page

1-(1,1-Dimethylethyl) 2-borono-5-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-1H-indole-1-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=913388-61-1 (retrieved 2024-07-02) (CAS RN: 913388-61-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H30BN3O5/c1-20(2,3)29-19(26)24-17-5-4-15(12-16(17)13-18(24)21(27)28)14-23-8-6-22(7-9-23)10-11-25/h4-5,12-13,25,27-28H,6-11,14H2,1-3H3

InChIKey

InChIKey=MCXMWVZFHCYQED-UHFFFAOYSA-N

SMILES

C(OC(C)(C)C)(=O)N1C=2C(C=C1B(O)O)=CC(CN3CCN(CCO)CC3)=CC2

Canonical SMILES

O=C(OC(C)(C)C)N1C(=CC=2C=C(C=CC21)CN3CCN(CCO)CC3)B(O)O

Other Names for this Substance

  • 1H-Indole-1-carboxylic acid, 2-borono-5-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-, 1-(1,1-dimethylethyl) ester
  • 1-(1,1-Dimethylethyl) 2-borono-5-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-1H-indole-1-carboxylate