1-Piperidinecarboxylic acid, 4-[bis(1,3-benzodioxol-5-yl)hydroxymethyl]-, 4-nitrophenyl ester

CAS Registry Number®

1101854-58-3
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CAS Name

1-Piperidinecarboxylic acid, 4-[bis(1,3-benzodioxol-5-yl)hydroxymethyl]-, 4-nitrophenyl ester

Molecular Formula

C27H24N2O9

Molecular Mass

520.49

Cite this Page

1-Piperidinecarboxylic acid, 4-[bis(1,3-benzodioxol-5-yl)hydroxymethyl]-, 4-nitrophenyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1101854-58-3 (retrieved 2024-03-28) (CAS RN: 1101854-58-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H24N2O9/c30-26(38-21-5-3-20(4-6-21)29(32)33)28-11-9-17(10-12-28)27(31,18-1-7-22-24(13-18)36-15-34-22)19-2-8-23-25(14-19)37-16-35-23/h1-8,13-14,17,31H,9-12,15-16H2

InChIKey

InChIKey=SEGYOKHGGFKMCX-UHFFFAOYSA-N

SMILES

C(O)(C=1C=C2C(=CC1)OCO2)(C=3C=C4C(=CC3)OCO4)C5CCN(C(OC6=CC=C(N(=O)=O)C=C6)=O)CC5

Canonical SMILES

O=C(OC1=CC=C(C=C1)N(=O)=O)N2CCC(CC2)C(O)(C3=CC=C4OCOC4=C3)C5=CC=C6OCOC6=C5

Other Names for this Substance

  • 1-Piperidinecarboxylic acid, 4-[bis(1,3-benzodioxol-5-yl)hydroxymethyl]-, 4-nitrophenyl ester
  • JZL 184

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