Isoquinoline, 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-, methanesulfonate (1:1)

CAS Registry Number®

61189-88-6

CAS Name

Isoquinoline, 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-, methanesulfonate (1:1)

Molecular Formula

C18H16ClNO2.CH4O3S

Cite this Page

Isoquinoline, 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-, methanesulfonate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=61189-88-6 (retrieved 2024-11-22) (CAS RN: 61189-88-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H16ClNO2.CH4O3S/c1-21-17-8-14-11-20-10-13(16(14)9-18(17)22-2)7-12-3-5-15(19)6-4-12;1-5(2,3)4/h3-6,8-11H,7H2,1-2H3;1H3,(H,2,3,4)

InChIKey

InChIKey=XQCSXUJTPZFYTN-UHFFFAOYSA-N

SMILES

C(C=1C2=C(C=C(OC)C(OC)=C2)C=NC1)C3=CC=C(Cl)C=C3.S(C)(=O)(=O)O

Canonical SMILES

O=S(=O)(O)C.ClC1=CC=C(C=C1)CC2=CN=CC3=CC(OC)=C(OC)C=C32

Other Names for this Substance

  • Isoquinoline, 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-, methanesulfonate (1:1)
  • Isoquinoline, 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-, methanesulfonate

Deleted or Replaced CAS Registry Numbers

114882-21-2