7-Methoxy-2-(3-Methoxybenzyl)-1,2,3,4-Tetrahydro-6-Isoquinolinyl Sulfamate

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Formula C18H22N2O5S
IUPAC Name [(2r)-7-methoxy-2-[(3-methoxyphenyl)methyl]-3,4-dihydro-1h-isoquinolin-6-yl] sulfamate
Molecular Mass 378.443 g·mol−1
Heat of Formation -610.4 ± 16.7 kJ·mol−1
Dipole Moment 7.77 ± 1.08 D
Volume 428.69 Å 3
Surface Area 379.44 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy -0.58 ± eV
Point Group Symmetry C1
Synonyms
  • [7-methoxy-2-[(3-methoxyphenyl)methyl]-3,4-dihydro-1h-isoquinolin-6-yl] sulfamate
  • sulfamic acid [7-methoxy-2-(3-methoxybenzyl)-3,4-dihydro-1h-isoquinolin-6-yl] ester
  • sulfamic acid [7-methoxy-2-[(3-methoxyphenyl)methyl]-3,4-dihydro-1h-isoquinolin-6-yl] ester
InChIKey BNHMNJHBVHWFAX-UHFFFAOYSA-N
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