3-Bromo-4-(4-methyl-1-piperazinyl)benzoic acid

CAS Registry Number®

1131622-55-3
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CAS Name

3-Bromo-4-(4-methyl-1-piperazinyl)benzoic acid

Molecular Formula

C12H15BrN2O2

Molecular Mass

299.16

Cite this Page

3-Bromo-4-(4-methyl-1-piperazinyl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1131622-55-3 (retrieved 2024-09-10) (CAS RN: 1131622-55-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H15BrN2O2/c1-14-4-6-15(7-5-14)11-3-2-9(12(16)17)8-10(11)13/h2-3,8H,4-7H2,1H3,(H,16,17)

InChIKey

InChIKey=USYGUVMUSGXQKK-UHFFFAOYSA-N

SMILES

BrC1=C(C=CC(C(O)=O)=C1)N2CCN(C)CC2

Canonical SMILES

O=C(O)C1=CC=C(C(Br)=C1)N2CCN(C)CC2

Other Names for this Substance

  • Benzoic acid, 3-bromo-4-(4-methyl-1-piperazinyl)-
  • 3-Bromo-4-(4-methyl-1-piperazinyl)benzoic acid