1-Piperidinecarboxylic acid, 4-[bis(1,3-benzodioxol-5-yl)hydroxymethyl]-, 4-nitrophenyl ester
CAS Registry Number®
1101854-58-3
CAS Name
1-Piperidinecarboxylic acid, 4-[bis(1,3-benzodioxol-5-yl)hydroxymethyl]-, 4-nitrophenyl esterMolecular Formula
C27H24N2O9Molecular Mass
520.49Cite 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 ) (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