2-[[5,6-bis(bromanyl)-1H-indol-3-yl]carbonylamino]butanoic acid

Systemtic Name: 2-[[5,6-bis(bromanyl)-1H-indol-3-yl]carbonylamino]butanoic acid Openeye Name: 2-[(5,6-dibromo-1H-indole-3-carbonyl)amino]butanoic acid CAS Name: 2-[[(5,6-dibromo-1H-indol-3-yl)-oxomethyl]amino]butanoic acid IUPAC Name: 2-[(5,6-dibromo-1H-indole-3-carbonyl)amino]butanoic acid Traditional Name: 2-[(5,6-dibromo-1H-indole-3-carbonyl)amino]butyric acid Formula: C13H12Br2N2O3 MolecularWeight: 404.05398

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C1=CNC2=CC(=C(C=C21)Br)Br

Isomeric SMILES

CCC(C(=O)O)NC(=O)C1=CNC2=CC(=C(C=C21)Br)Br

InChI

InChI=1S/C13H12Br2N2O3/c1-2-10(13(19)20)17-12(18)7-5-16-11-4-9(15)8(14)3-6(7)11/h3-5,10,16H,2H2,1H3,(H,17,18)(H,19,20)