OAQ

{(2S)-7-nitro-2-[(propan-2-ylamino)methyl]-1,2,3,4-tetrahydroquinolin-6-yl}methanol


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Chemical Component Summary

Name{(2S)-7-nitro-2-[(propan-2-ylamino)methyl]-1,2,3,4-tetrahydroquinolin-6-yl}methanol
SynonymsOxamniquine
Identifiers[(2S)-7-nitro-2-[(propan-2-ylamino)methyl]-1,2,3,4-tetrahydroquinolin-6-yl]methanol
FormulaC14 H21 N3 O3
Molecular Weight279.335
TypeNON-POLYMER
Isomeric SMILESCC(C)NC[C@@H]1CCc2cc(c(cc2N1)[N+](=O)[O-])CO
InChIInChI=1S/C14H21N3O3/c1-9(2)15-7-12-4-3-10-5-11(8-18)14(17(19)20)6-13(10)16-12/h5-6,9,12,15-16,18H,3-4,7-8H2,1-2H3/t12-/m0/s1
InChIKeyXCGYUJZMCCFSRP-LBPRGKRZSA-N

Chemical Details

Formal Charge0
Atom Count41
Chiral Atom Count1
Bond Count42
Aromatic Bond Count6

Related Resource References

Resource NameReference
PubChem 28125495
ChEBI CHEBI:78418