5-chloranyl-1-ethoxycarbonyl-indole-3-carboxylic acid

Systemtic Name: 5-chloranyl-1-ethoxycarbonyl-indole-3-carboxylic acid Openeye Name: 5-chloro-1-ethoxycarbonyl-indole-3-carboxylic acid CAS Name: 5-chloro-1-ethoxycarbonyl-3-indolecarboxylic acid IUPAC Name: 5-chloro-1-ethoxycarbonylindole-3-carboxylic acid Traditional Name: 1-carbethoxy-5-chloro-indole-3-carboxylic acid Formula: C12H10ClNO4 MolecularWeight: 267.6651

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=C(C2=C1C=CC(=C2)Cl)C(=O)O

Isomeric SMILES

CCOC(=O)N1C=C(C2=C1C=CC(=C2)Cl)C(=O)O

InChI

InChI=1S/C12H10ClNO4/c1-2-18-12(17)14-6-9(11(15)16)8-5-7(13)3-4-10(8)14/h3-6H,2H2,1H3,(H,15,16)