4-Pyridinecarboxylic acid, 2-(hexahydro-1H-1,4-diazepin-1-yl)-, methyl ester, hydrochloride (1:1)

CAS Registry Number®

1235439-20-9
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CAS Name

4-Pyridinecarboxylic acid, 2-(hexahydro-1H-1,4-diazepin-1-yl)-, methyl ester, hydrochloride (1:1)

Molecular Formula

C12H17N3O2.ClH

Cite this Page

4-Pyridinecarboxylic acid, 2-(hexahydro-1H-1,4-diazepin-1-yl)-, methyl ester, hydrochloride (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1235439-20-9 (retrieved 2024-09-06) (CAS RN: 1235439-20-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H17N3O2.ClH/c1-17-12(16)10-3-5-14-11(9-10)15-7-2-4-13-6-8-15;/h3,5,9,13H,2,4,6-8H2,1H3;1H

InChIKey

InChIKey=BSROCTMOVKNUFL-UHFFFAOYSA-N

SMILES

C(OC)(=O)C=1C=C(N=CC1)N2CCCNCC2.Cl

Canonical SMILES

Cl.O=C(OC)C=1C=CN=C(C1)N2CCNCCC2

Other Names for this Substance

  • 4-Pyridinecarboxylic acid, 2-(hexahydro-1H-1,4-diazepin-1-yl)-, methyl ester, hydrochloride (1:1)