2-azanyl-3-[2-(4-bromanyl-1H-indol-3-yl)ethanoylamino]propanoic acid

Systemtic Name: 2-azanyl-3-[2-(4-bromanyl-1H-indol-3-yl)ethanoylamino]propanoic acid Openeye Name: 2-amino-3-[[2-(4-bromo-1H-indol-3-yl)acetyl]amino]propanoic acid CAS Name: 2-amino-3-[[2-(4-bromo-1H-indol-3-yl)-1-oxoethyl]amino]propanoic acid IUPAC Name: 2-amino-3-[[2-(4-bromo-1H-indol-3-yl)acetyl]amino]propanoic acid Traditional Name: 2-amino-3-[[2-(4-bromo-1H-indol-3-yl)acetyl]amino]propionic acid Formula: C13H14BrN3O3 MolecularWeight: 340.17256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Br)C(=CN2)CC(=O)NCC(C(=O)O)N

Isomeric SMILES

C1=CC2=C(C(=C1)Br)C(=CN2)CC(=O)NCC(C(=O)O)N

InChI

InChI=1S/C13H14BrN3O3/c14-8-2-1-3-10-12(8)7(5-16-10)4-11(18)17-6-9(15)13(19)20/h1-3,5,9,16H,4,6,15H2,(H,17,18)(H,19,20)