4-bromanyl-3-ethanoyl-1-methyl-indole-2-carboxylic acid

Systemtic Name: 4-bromanyl-3-ethanoyl-1-methyl-indole-2-carboxylic acid Openeye Name: 3-acetyl-4-bromo-1-methyl-indole-2-carboxylic acid CAS Name: 3-acetyl-4-bromo-1-methyl-2-indolecarboxylic acid IUPAC Name: 3-acetyl-4-bromo-1-methylindole-2-carboxylic acid Traditional Name: 3-acetyl-4-bromo-1-methyl-indole-2-carboxylic acid Formula: C12H10BrNO3 MolecularWeight: 296.1167

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C2=C1C(=CC=C2)Br)C)C(=O)O

Isomeric SMILES

CC(=O)C1=C(N(C2=C1C(=CC=C2)Br)C)C(=O)O

InChI

InChI=1S/C12H10BrNO3/c1-6(15)9-10-7(13)4-3-5-8(10)14(2)11(9)12(16)17/h3-5H,1-2H3,(H,16,17)