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(2S)-3-(5-bromanyl-1H-indol-3-yl)-2-(methylamino)propanoic acid

(2S)-3-(5-bromanyl-1H-indol-3-yl)-2-(methylamino)propanoic acid

Systemtic Name:(2S)-3-(5-bromanyl-1H-indol-3-yl)-2-(methylamino)propanoic acid
Openeye Name:(2S)-3-(5-bromo-1H-indol-3-yl)-2-(methylamino)propanoic acid
CAS Name:(2S)-3-(5-bromo-1H-indol-3-yl)-2-(methylamino)propanoic acid
IUPAC Name:(2S)-3-(5-bromo-1H-indol-3-yl)-2-(methylamino)propanoic acid
Traditional Name:(2S)-3-(5-bromo-1H-indol-3-yl)-2-(methylamino)propionic acid
Formula: C12H13BrN2O2
MolecularWeight: 297.14782
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Descriptors Computed from Structure

Canonical SMILES:

CNC(CC1=CNC2=C1C=C(C=C2)Br)C(=O)O


Isomeric SMILES

CN[C@@H](CC1=CNC2=C1C=C(C=C2)Br)C(=O)O


InChI

InChI=1S/C12H13BrN2O2/c1-14-11(12(16)17)4-7-6-15-10-3-2-8(13)5-9(7)10/h2-3,5-6,11,14-15H,4H2,1H3,(H,16,17)/t11-/m0/s1


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