Pyrimido[1,2-a]azepinium, 2,3,4,6,7,8,9,10-octahydro-1-(phenylmethyl)-, chloride (1:1)

CAS Registry Number®

49663-94-7
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CAS Name

Pyrimido[1,2-a]azepinium, 2,3,4,6,7,8,9,10-octahydro-1-(phenylmethyl)-, chloride (1:1)

Molecular Formula

C16H23N2.Cl

Cite this Page

Pyrimido[1,2-a]azepinium, 2,3,4,6,7,8,9,10-octahydro-1-(phenylmethyl)-, chloride (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=49663-94-7 (retrieved 2024-07-07) (CAS RN: 49663-94-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H23N2.ClH/c1-3-8-15(9-4-1)14-18-13-7-12-17-11-6-2-5-10-16(17)18;/h1,3-4,8-9H,2,5-7,10-14H2;1H/q+1;/p-1

InChIKey

InChIKey=CIIDVPBPKJUNNK-UHFFFAOYSA-M

SMILES

C([N+]1=C2N(CCC1)CCCCC2)C3=CC=CC=C3.[Cl-]

Canonical SMILES

[Cl-].C=1C=CC(=CC1)C[N+]2=C3N(CCC2)CCCCC3

Other Names for this Substance

  • Pyrimido[1,2-a]azepinium, 2,3,4,6,7,8,9,10-octahydro-1-(phenylmethyl)-, chloride (1:1)
  • Pyrimido[1,2-a]azepinium, 2,3,4,6,7,8,9,10-octahydro-1-(phenylmethyl)-, chloride
  • 8-Benzyl-1,8-diazabicyclo[5.4.0]undec-7-enium chloride
  • N-8-Benzyl-1,8-diazabicyclo[5.4.0]undec-7-ene ammonium chloride
  • 1-Benzyl-1H,2H,3H,4H,6H,7H,8H,9H,10H-5λ5-pyrimido[1,2-a]azepin-5-ylium chloride

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Deleted or Replaced CAS Registry Numbers

113403-07-9