Methyl 3-amino-2-[[4-(2,6-dimethylphenyl)-1-piperazinyl]methyl]benzoate

CAS Registry Number®

865660-19-1
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CAS Name

Methyl 3-amino-2-[[4-(2,6-dimethylphenyl)-1-piperazinyl]methyl]benzoate

Molecular Formula

C21H27N3O2

Molecular Mass

353.46

Cite this Page

Methyl 3-amino-2-[[4-(2,6-dimethylphenyl)-1-piperazinyl]methyl]benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=865660-19-1 (retrieved 2024-08-14) (CAS RN: 865660-19-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H27N3O2/c1-15-6-4-7-16(2)20(15)24-12-10-23(11-13-24)14-18-17(21(25)26-3)8-5-9-19(18)22/h4-9H,10-14,22H2,1-3H3

InChIKey

InChIKey=IBBWSQHOBDVPGV-UHFFFAOYSA-N

SMILES

CC1=C(C(C)=CC=C1)N2CCN(CC3=C(C(OC)=O)C=CC=C3N)CC2

Canonical SMILES

O=C(OC)C=1C=CC=C(N)C1CN2CCN(C=3C(=CC=CC3C)C)CC2

Other Names for this Substance

  • Benzoic acid, 3-amino-2-[[4-(2,6-dimethylphenyl)-1-piperazinyl]methyl]-, methyl ester
  • Methyl 3-amino-2-[[4-(2,6-dimethylphenyl)-1-piperazinyl]methyl]benzoate