3-Pyridinecarboxylic acid, compd. with 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline (1:1)

CAS Registry Number®

1748-09-0
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CAS Name

3-Pyridinecarboxylic acid, compd. with 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline (1:1)

Molecular Formula

C20H21NO4.C6H5NO2

Cite this Page

3-Pyridinecarboxylic acid, compd. with 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1748-09-0 (retrieved 2024-08-22) (CAS RN: 1748-09-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    143-145 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H21NO4.C6H5NO2/c1-22-17-6-5-13(10-18(17)23-2)9-16-15-12-20(25-4)19(24-3)11-14(15)7-8-21-16;8-6(9)5-2-1-3-7-4-5/h5-8,10-12H,9H2,1-4H3;1-4H,(H,8,9)

InChIKey

InChIKey=NPAQBIPXGQGMRE-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1C=CC=NC1.C(C=1C2=C(C=C(OC)C(OC)=C2)C=CN1)C3=CC(OC)=C(OC)C=C3

Canonical SMILES

O=C(O)C=1C=NC=CC1.N=1C=CC=2C=C(OC)C(OC)=CC2C1CC3=CC=C(OC)C(OC)=C3

Other Names for this Substance

  • 3-Pyridinecarboxylic acid, compd. with 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline (1:1)
  • Papaverine, nicotinate
  • Isoquinoline, 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-, 3-pyridinecarboxylate
  • Nicotinic acid compd. with papaverine (1:1)
  • Nicopavin

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