3-[2-(6-bromanylindol-1-yl)ethanoylamino]propanoic acid

Systemtic Name: 3-[2-(6-bromanylindol-1-yl)ethanoylamino]propanoic acid Openeye Name: 3-[[2-(6-bromoindol-1-yl)acetyl]amino]propanoic acid CAS Name: 3-[[2-(6-bromo-1-indolyl)-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-[[2-(6-bromoindol-1-yl)acetyl]amino]propanoic acid Traditional Name: 3-[[2-(6-bromoindol-1-yl)acetyl]amino]propionic acid Formula: C13H13BrN2O3 MolecularWeight: 325.15792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CN2CC(=O)NCCC(=O)O)Br

Isomeric SMILES

C1=CC(=CC2=C1C=CN2CC(=O)NCCC(=O)O)Br

InChI

InChI=1S/C13H13BrN2O3/c14-10-2-1-9-4-6-16(11(9)7-10)8-12(17)15-5-3-13(18)19/h1-2,4,6-7H,3,5,8H2,(H,15,17)(H,18,19)