Benzoic acid, 6-[2-[6-[2-(dimethylamino)ethyl]-4-methoxy-1,3-benzodioxol-5-yl]acetyl]-2,3-dimethoxy-, ethyl ester, hydrochloride (1:1)

CAS Registry Number®

12246-80-9

CAS Name

Benzoic acid, 6-[2-[6-[2-(dimethylamino)ethyl]-4-methoxy-1,3-benzodioxol-5-yl]acetyl]-2,3-dimethoxy-, ethyl ester, hydrochloride (1:1)

Molecular Formula

C25H31NO8.ClH

Cite this Page

Benzoic acid, 6-[2-[6-[2-(dimethylamino)ethyl]-4-methoxy-1,3-benzodioxol-5-yl]acetyl]-2,3-dimethoxy-, ethyl ester, hydrochloride (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=12246-80-9 (retrieved 2024-11-22) (CAS RN: 12246-80-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    208-210 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C25H31NO8.ClH/c1-7-32-25(28)21-16(8-9-19(29-4)23(21)31-6)18(27)13-17-15(10-11-26(2)3)12-20-24(22(17)30-5)34-14-33-20;/h8-9,12H,7,10-11,13-14H2,1-6H3;1H

InChIKey

InChIKey=SXGYMZFWDNUKTQ-UHFFFAOYSA-N

SMILES

C(C(=O)C1=C(C(OCC)=O)C(OC)=C(OC)C=C1)C=2C(OC)=C3C(=CC2CCN(C)C)OCO3.Cl

Canonical SMILES

Cl.O=C(OCC)C1=C(OC)C(OC)=CC=C1C(=O)CC2=C(OC)C=3OCOC3C=C2CCN(C)C

Other Names for this Substance

  • Benzoic acid, 6-[2-[6-[2-(dimethylamino)ethyl]-4-methoxy-1,3-benzodioxol-5-yl]acetyl]-2,3-dimethoxy-, ethyl ester, hydrochloride (1:1)
  • Narceine, ethyl-, hydrochloride
  • Benzoic acid, 6-[[6-[2-(dimethylamino)ethyl]-4-methoxy-1,3-benzodioxol-5-yl]acetyl]-2,3-dimethoxy-, ethyl ester, hydrochloride
  • Ethylnarceine hydrochloride
  • Narcyl

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Deleted or Replaced CAS Registry Numbers

65945-26-8