Octoclothepin maleate
CAS Registry Number®
4789-68-8
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CAS Name
Octoclothepin maleateMolecular Formula
C19H21ClN2S.C4H4O4Cite this Page
Octoclothepin maleate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=4789-68-8 (retrieved ) (CAS RN: 4789-68-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C19H21ClN2S.C4H4O4/c1-21-8-10-22(11-9-21)17-12-14-4-2-3-5-18(14)23-19-7-6-15(20)13-16(17)19;5-3(6)1-2-4(7)8/h2-7,13,17H,8-12H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
InChIKey
InChIKey=GWKBZIADWSOIQV-BTJKTKAUSA-N
SMILES
ClC=1C=C2C(CC=3C(SC2=CC1)=CC=CC3)N4CCN(C)CC4.C(=C\C(O)=O)\C(O)=O
Canonical SMILES
O=C(O)C=CC(=O)O.ClC1=CC=C2SC=3C=CC=CC3CC(C2=C1)N4CCN(C)CC4
Other Names for this Substance
- Piperazine, 1-(8-chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)-4-methyl-, (2Z)-2-butenedioate (1:1)
- Piperazine, 1-(8-chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)-4-methyl-, maleate (1:1)
- Piperazine, 1-(8-chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)-4-methyl-, (Z)-2-butenedioate (1:1)
- Dibenzo[b,f]thiepin, piperazine deriv.
- Octoclothepin maleate
Deleted or Replaced CAS Registry Numbers
41931-03-7
