5-acetyloxy-1-ethanoyl-indole-2-carboxylic acid

Systemtic Name: 5-acetyloxy-1-ethanoyl-indole-2-carboxylic acid Openeye Name: 5-acetoxy-1-acetyl-indole-2-carboxylic acid CAS Name: 1-acetyl-5-acetyloxy-2-indolecarboxylic acid IUPAC Name: 1-acetyl-5-acetyloxyindole-2-carboxylic acid Traditional Name: 5-acetoxy-1-acetyl-indole-2-carboxylic acid Formula: C13H11NO5 MolecularWeight: 261.23014

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=C(C=C(C=C2)OC(=O)C)C=C1C(=O)O

Isomeric SMILES

CC(=O)N1C2=C(C=C(C=C2)OC(=O)C)C=C1C(=O)O

InChI

InChI=1S/C13H11NO5/c1-7(15)14-11-4-3-10(19-8(2)16)5-9(11)6-12(14)13(17)18/h3-6H,1-2H3,(H,17,18)