3-Pyridinol, 6-[2-[(1-methylethyl)amino]propyl]-, (2E)-2-butenedioate (1:1) (salt)

CAS Registry Number®

76906-80-4

CAS Name

3-Pyridinol, 6-[2-[(1-methylethyl)amino]propyl]-, (2E)-2-butenedioate (1:1) (salt)

Molecular Formula

C11H18N2O.C4H4O4

Cite this Page

3-Pyridinol, 6-[2-[(1-methylethyl)amino]propyl]-, (2E)-2-butenedioate (1:1) (salt).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=78997-41-8 (retrieved 2024-12-29) (CAS RN: 76906-80-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H18N2O.C4H4O4/c1-8(2)13-9(3)6-10-4-5-11(14)7-12-10;5-3(6)1-2-4(7)8/h4-5,7-9,13-14H,6H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

InChIKey=FNBJFWHBTSGFGU-WLHGVMLRSA-N

SMILES

C(C(NC(C)C)C)C1=CC=C(O)C=N1.C(=C/C(O)=O)\C(O)=O

Canonical SMILES

O=C(O)C=CC(=O)O.OC1=CN=C(C=C1)CC(NC(C)C)C

Other Names for this Substance

  • 3-Pyridinol, 6-[2-[(1-methylethyl)amino]propyl]-, (2E)-2-butenedioate (1:1) (salt)
  • 3-Pyridinol, 6-[2-[(1-methylethyl)amino]propyl]-, (E)-2-butenedioate (1:1) (salt)

Deleted or Replaced CAS Registry Numbers

78997-41-8

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