4-[[5,6-bis(bromanyl)-1H-indol-3-yl]carbonyl-methyl-amino]butanoic acid

Systemtic Name: 4-[[5,6-bis(bromanyl)-1H-indol-3-yl]carbonyl-methyl-amino]butanoic acid Openeye Name: 4-[(5,6-dibromo-1H-indole-3-carbonyl)-methyl-amino]butanoic acid CAS Name: 4-[[(5,6-dibromo-1H-indol-3-yl)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[(5,6-dibromo-1H-indole-3-carbonyl)-methylamino]butanoic acid Traditional Name: 4-[(5,6-dibromo-1H-indole-3-carbonyl)-methyl-amino]butyric acid Formula: C14H14Br2N2O3 MolecularWeight: 418.08056

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)C1=CNC2=CC(=C(C=C21)Br)Br

Isomeric SMILES

CN(CCCC(=O)O)C(=O)C1=CNC2=CC(=C(C=C21)Br)Br

InChI

InChI=1S/C14H14Br2N2O3/c1-18(4-2-3-13(19)20)14(21)9-7-17-12-6-11(16)10(15)5-8(9)12/h5-7,17H,2-4H2,1H3,(H,19,20)