Isoquinolinium, 1-[[4-[5-[(6,7-dimethoxy-2-methylisoquinolinium-1-yl)methyl]-2-methoxyphenoxy]phenyl]methyl]-6,7-dimethoxy-2-methyl-

CAS Registry Number®

27670-80-0

CAS Name

Isoquinolinium, 1-[[4-[5-[(6,7-dimethoxy-2-methylisoquinolinium-1-yl)methyl]-2-methoxyphenoxy]phenyl]methyl]-6,7-dimethoxy-2-methyl-

Molecular Formula

C39H40N2O6

Cite this Page

Isoquinolinium, 1-[[4-[5-[(6,7-dimethoxy-2-methylisoquinolinium-1-yl)methyl]-2-methoxyphenoxy]phenyl]methyl]-6,7-dimethoxy-2-methyl-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=27670-80-0 (retrieved 2024-11-25) (CAS RN: 27670-80-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C39H40N2O6/c1-40-16-14-27-21-35(43-4)37(45-6)23-30(27)32(40)18-25-8-11-29(12-9-25)47-39-20-26(10-13-34(39)42-3)19-33-31-24-38(46-7)36(44-5)22-28(31)15-17-41(33)2/h8-17,20-24H,18-19H2,1-7H3/q+2

InChIKey

InChIKey=IWKHGZDMTOKGQP-UHFFFAOYSA-N

SMILES

C(C=1C2=C(C=C(OC)C(OC)=C2)C=C[N+]1C)C3=CC(OC4=CC=C(CC=5C6=C(C=C(OC)C(OC)=C6)C=C[N+]5C)C=C4)=C(OC)C=C3

Canonical SMILES

O(C1=CC=C(C=C1)CC2=C3C=C(OC)C(OC)=CC3=CC=[N+]2C)C4=CC(=CC=C4OC)CC5=C6C=C(OC)C(OC)=CC6=CC=[N+]5C

Other Names for this Substance

  • Isoquinolinium, 1-[[4-[5-[(6,7-dimethoxy-2-methylisoquinolinium-1-yl)methyl]-2-methoxyphenoxy]phenyl]methyl]-6,7-dimethoxy-2-methyl-
  • Phaeantharine
  • Pheantharine

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