3-(isoquinolin-4-ylmethoxy)-N-(3,4,5-trimethoxyphenyl)benzamide hydrochloride

Systemtic Name: 3-(isoquinolin-4-ylmethoxy)-N-(3,4,5-trimethoxyphenyl)benzamide hydrochloride Openeye Name: 3-(4-isoquinolylmethoxy)-N-(3,4,5-trimethoxyphenyl)benzamide hydrochloride CAS Name: 3-(4-isoquinolinylmethoxy)-N-(3,4,5-trimethoxyphenyl)benzamide hydrochloride IUPAC Name: 3-(isoquinolin-4-ylmethoxy)-N-(3,4,5-trimethoxyphenyl)benzamide hydrochloride Traditional Name: 3-(4-isoquinolylmethoxy)-N-(3,4,5-trimethoxyphenyl)benzamide hydrochloride Formula: C26H25ClN2O5 MolecularWeight: 480.9401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=CC(=CC=C2)OCC3=CN=CC4=CC=CC=C43.Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=CC(=CC=C2)OCC3=CN=CC4=CC=CC=C43.Cl

InChI

InChI=1S/C26H24N2O5.ClH/c1-30-23-12-20(13-24(31-2)25(23)32-3)28-26(29)17-8-6-9-21(11-17)33-16-19-15-27-14-18-7-4-5-10-22(18)19;/h4-15H,16H2,1-3H3,(H,28,29);1H