Methyl 2-(4-aminophenyl)-1,2-dihydro-1-oxo-7-(2-pyridinylmethoxy)-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylate sulfate (1:1)

CAS Registry Number®

212500-03-3

CAS Name

Methyl 2-(4-aminophenyl)-1,2-dihydro-1-oxo-7-(2-pyridinylmethoxy)-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylate sulfate (1:1)

Molecular Formula

C32H29N3O7.H2O4S

Cite this Page

Methyl 2-(4-aminophenyl)-1,2-dihydro-1-oxo-7-(2-pyridinylmethoxy)-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylate sulfate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=212500-03-3 (retrieved 2025-01-05) (CAS RN: 212500-03-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    221-223 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C32H29N3O7.H2O4S/c1-38-26-15-19(16-27(39-2)30(26)40-3)28-24-13-12-23(42-18-21-7-5-6-14-34-21)17-25(24)31(36)35(29(28)32(37)41-4)22-10-8-20(33)9-11-22;1-5(2,3)4/h5-17H,18,33H2,1-4H3;(H2,1,2,3,4)

InChIKey

InChIKey=NVGOUBIJVPSVSL-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1=C(C=2C(C(=O)N1C3=CC=C(N)C=C3)=CC(OCC4=CC=CC=N4)=CC2)C5=CC(OC)=C(OC)C(OC)=C5.S(=O)(=O)(O)O

Canonical SMILES

O=C(OC)C1=C(C=2C=C(OC)C(OC)=C(OC)C2)C=3C=CC(OCC4=NC=CC=C4)=CC3C(=O)N1C5=CC=C(N)C=C5.O=S(=O)(O)O

Other Names for this Substance

  • 3-Isoquinolinecarboxylic acid, 2-(4-aminophenyl)-1,2-dihydro-1-oxo-7-(2-pyridinylmethoxy)-4-(3,4,5-trimethoxyphenyl)-, methyl ester, sulfate (1:1)
  • Methyl 2-(4-aminophenyl)-1,2-dihydro-1-oxo-7-(2-pyridinylmethoxy)-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylate sulfate (1:1)
  • T 1032

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