4,6-bis(chloranyl)-3-propanoyloxy-1H-indole-2-carboxylic acid

Systemtic Name: 4,6-bis(chloranyl)-3-propanoyloxy-1H-indole-2-carboxylic acid Openeye Name: 4,6-dichloro-3-propanoyloxy-1H-indole-2-carboxylic acid CAS Name: 4,6-dichloro-3-(1-oxopropoxy)-1H-indole-2-carboxylic acid IUPAC Name: 4,6-dichloro-3-propanoyloxy-1H-indole-2-carboxylic acid Traditional Name: 4,6-dichloro-3-propionyloxy-1H-indole-2-carboxylic acid Formula: C12H9Cl2NO4 MolecularWeight: 302.11016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(NC2=CC(=CC(=C21)Cl)Cl)C(=O)O

Isomeric SMILES

CCC(=O)OC1=C(NC2=CC(=CC(=C21)Cl)Cl)C(=O)O

InChI

InChI=1S/C12H9Cl2NO4/c1-2-8(16)19-11-9-6(14)3-5(13)4-7(9)15-10(11)12(17)18/h3-4,15H,2H2,1H3,(H,17,18)