2-bromo-N-{2-[(6,7-dimethoxy-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl}benzamide

SpectraBase Compound ID	GqpgZ3IfgK3
InChI	InChI=1S/C27H25BrN2O5/c1-32-23-12-16-9-10-29-22(19(16)14-25(23)34-3)11-17-13-24(33-2)26(35-4)15-21(17)30-27(31)18-7-5-6-8-20(18)28/h5-10,12-15H,11H2,1-4H3,(H,30,31)
InChIKey	YUILNPQOPRWKEU-UHFFFAOYSA-N Google Search
Mol Weight	537.41 g/mol
Molecular Formula	C27H25BrN2O5
Exact Mass	536.094685 g/mol

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SpectraBase Spectrum ID	7I6PjccrziP
Name	2-Bromo-N-{2-[(6,7-dimethoxy-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl}benzamide
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	536.094684908 u
Formula	C27H25BrN2O5
InChI	InChI=1S/C27H25BrN2O5/c1-32-23-12-16-9-10-29-22(19(16)14-25(23)34-3)11-17-13-24(33-2)26(35-4)15-21(17)30-27(31)18-7-5-6-8-20(18)28/h5-10,12-15H,11H2,1-4H3,(H,30,31)
InChIKey	YUILNPQOPRWKEU-UHFFFAOYSA-N
Molecular Weight	537.410 g/mol
SMILES	N(C(C1=C(Br)C=CC=C1)=O)C=1C(CC=2C=3C=C(OC)C(=CC3C=CN2)OC)=CC(=C(C1)OC)OC