3-Pyridinemethanamine, N-[2-[(hexahydro-1H-azepin-1-yl)sulfonyl]ethyl]-, ethanedioate (1:1)
CAS Registry Number®
1332530-96-7
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CAS Name
3-Pyridinemethanamine, N-[2-[(hexahydro-1H-azepin-1-yl)sulfonyl]ethyl]-, ethanedioate (1:1)Molecular Formula
C14H23N3O2S.C2H2O4Cite this Page
3-Pyridinemethanamine, N-[2-[(hexahydro-1H-azepin-1-yl)sulfonyl]ethyl]-, ethanedioate (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1332530-96-7 (retrieved ) (CAS RN: 1332530-96-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C14H23N3O2S.C2H2O4/c18-20(19,17-9-3-1-2-4-10-17)11-8-16-13-14-6-5-7-15-12-14;3-1(4)2(5)6/h5-7,12,16H,1-4,8-11,13H2;(H,3,4)(H,5,6)
InChIKey
InChIKey=RDLLUNSXJNLNPF-UHFFFAOYSA-N
SMILES
S(CCNCC=1C=CC=NC1)(=O)(=O)N2CCCCCC2.C(C(O)=O)(O)=O
Canonical SMILES
O=C(O)C(=O)O.O=S(=O)(N1CCCCCC1)CCNCC=2C=NC=CC2
Other Names for this Substance
- 3-Pyridinemethanamine, N-[2-[(hexahydro-1H-azepin-1-yl)sulfonyl]ethyl]-, ethanedioate (1:1)