94A

(4R,7S)-7-hydroxy-1-(4-methoxybenzyl)-7-methyl-4,5,6,7-tetrahydro-1H-benzotriazol-4-yl propan-2-ylcarbamate



Chemical Component Summary

Name(4R,7S)-7-hydroxy-1-(4-methoxybenzyl)-7-methyl-4,5,6,7-tetrahydro-1H-benzotriazol-4-yl propan-2-ylcarbamate
Identifiers[(4R,7S)-1-[(4-methoxyphenyl)methyl]-7-methyl-7-oxidanyl-5,6-dihydro-4H-benzotriazol-4-yl] N-propan-2-ylcarbamate
FormulaC19 H26 N4 O4
Molecular Weight374.434
TypeNON-POLYMER
Isomeric SMILESCC(C)NC(=O)O[C@@H]1CC[C@](c2c1nnn2Cc3ccc(cc3)OC)(C)O
InChIInChI=1S/C19H26N4O4/c1-12(2)20-18(24)27-15-9-10-19(3,25)17-16(15)21-22-23(17)11-13-5-7-14(26-4)8-6-13/h5-8,12,15,25H,9-11H2,1-4H3,(H,20,24)/t15-,19+/m1/s1
InChIKeyCDAJJINZTVFCPA-BEFAXECRSA-N

Chemical Details

Formal Charge0
Atom Count53
Chiral Atom Count2
Bond Count55
Aromatic Bond Count11

Related Resource References

Resource NameReference
PubChem 137348784