4-(5-bromanyl-1H-indol-3-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(5-bromanyl-1H-indol-3-yl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(5-bromo-1H-indol-3-yl)-4-oxo-butanoic acid CAS Name: 4-(5-bromo-1H-indol-3-yl)-4-oxobutanoic acid IUPAC Name: 4-(5-bromo-1H-indol-3-yl)-4-oxobutanoic acid Traditional Name: 4-(5-bromo-1H-indol-3-yl)-4-keto-butyric acid Formula: C12H10BrNO3 MolecularWeight: 296.1167

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=CN2)C(=O)CCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Br)C(=CN2)C(=O)CCC(=O)O

InChI

InChI=1S/C12H10BrNO3/c13-7-1-2-10-8(5-7)9(6-14-10)11(15)3-4-12(16)17/h1-2,5-6,14H,3-4H2,(H,16,17)