6-chloranyl-3-(2-ethoxy-2-oxidanylidene-ethyl)-1H-indole-2-carboxylic acid

Systemtic Name: 6-chloranyl-3-(2-ethoxy-2-oxidanylidene-ethyl)-1H-indole-2-carboxylic acid Openeye Name: 6-chloro-3-(2-ethoxy-2-oxo-ethyl)-1H-indole-2-carboxylic acid CAS Name: 6-chloro-3-(2-ethoxy-2-oxoethyl)-1H-indole-2-carboxylic acid IUPAC Name: 6-chloro-3-(2-ethoxy-2-oxoethyl)-1H-indole-2-carboxylic acid Traditional Name: 6-chloro-3-(2-ethoxy-2-keto-ethyl)-1H-indole-2-carboxylic acid Formula: C13H12ClNO4 MolecularWeight: 281.69168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(NC2=C1C=CC(=C2)Cl)C(=O)O

Isomeric SMILES

CCOC(=O)CC1=C(NC2=C1C=CC(=C2)Cl)C(=O)O

InChI

InChI=1S/C13H12ClNO4/c1-2-19-11(16)6-9-8-4-3-7(14)5-10(8)15-12(9)13(17)18/h3-5,15H,2,6H2,1H3,(H,17,18)