Methyl 3-iodo-4-(1-piperazinylmethyl)benzoate

CAS Registry Number®

1131614-86-2

CAS Name

Methyl 3-iodo-4-(1-piperazinylmethyl)benzoate

Molecular Formula

C13H17IN2O2

Molecular Mass

360.19

Cite this Page

Methyl 3-iodo-4-(1-piperazinylmethyl)benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1131614-86-2 (retrieved 2024-11-24) (CAS RN: 1131614-86-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H17IN2O2/c1-18-13(17)10-2-3-11(12(14)8-10)9-16-6-4-15-5-7-16/h2-3,8,15H,4-7,9H2,1H3

InChIKey

InChIKey=FDOQXLPZOUOLLE-UHFFFAOYSA-N

SMILES

C(C1=C(I)C=C(C(OC)=O)C=C1)N2CCNCC2

Canonical SMILES

O=C(OC)C1=CC=C(C(I)=C1)CN2CCNCC2

Other Names for this Substance

  • Benzoic acid, 3-iodo-4-(1-piperazinylmethyl)-, methyl ester
  • Methyl 3-iodo-4-(1-piperazinylmethyl)benzoate

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