MS5

7-methoxy-2-(3-methoxybenzyl)-1,2,3,4-tetrahydroisoquinolin-6-yl sulfamate


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Chemical Component Summary

Name7-methoxy-2-(3-methoxybenzyl)-1,2,3,4-tetrahydroisoquinolin-6-yl sulfamate
Synonyms2-(3-methoxybenzyl)-6-O-sulfamoyl-7-methoxy-1,2,3,4-tetrahydroisoquinoline
Identifiers[(2R)-7-methoxy-2-[(3-methoxyphenyl)methyl]-3,4-dihydro-1H-isoquinolin-6-yl] sulfamate
FormulaC18 H22 N2 O5 S
Molecular Weight378.443
TypeNON-POLYMER
Isomeric SMILESCOc1cccc(c1)C[N@]2CCc3cc(c(cc3C2)OC)OS(=O)(=O)N
InChIInChI=1S/C18H22N2O5S/c1-23-16-5-3-4-13(8-16)11-20-7-6-14-9-18(25-26(19,21)22)17(24-2)10-15(14)12-20/h3-5,8-10H,6-7,11-12H2,1-2H3,(H2,19,21,22)
InChIKeyBNHMNJHBVHWFAX-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count48
Chiral Atom Count0
Bond Count50
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 24776447
ChEMBL CHEMBL1234474