Chemical Component Summary

Name7-({4-[(3-hydroxy-5-methoxyphenyl)amino]benzoyl}amino)-1,2,3,4-tetrahydroisoquinolinium
Identifiers4-[(3-methoxy-5-oxidanyl-phenyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl)benzamide
FormulaC23 H24 N3 O3
Molecular Weight390.455
TypeNON-POLYMER
Isomeric SMILESCOc1cc(cc(c1)O)Nc2ccc(cc2)C(=O)Nc3ccc4c(c3)C[NH2+]CC4
InChIInChI=1S/C23H23N3O3/c1-29-22-12-20(11-21(27)13-22)25-18-5-3-16(4-6-18)23(28)26-19-7-2-15-8-9-24-14-17(15)10-19/h2-7,10-13,24-25,27H,8-9,14H2,1H3,(H,26,28)/p+1
InChIKeyIVDJYLJJRBVWIX-UHFFFAOYSA-O

Chemical Details

Formal Charge1
Atom Count53
Chiral Atom Count0
Bond Count56
Aromatic Bond Count18

Related Resource References

Resource NameReference
PubChem 78350435