ethyl 1-(cyanomethyl)-3-iodanyl-indole-2-carboxylate

Systemtic Name: ethyl 1-(cyanomethyl)-3-iodanyl-indole-2-carboxylate Openeye Name: ethyl 1-(cyanomethyl)-3-iodo-indole-2-carboxylate CAS Name: 1-(cyanomethyl)-3-iodo-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(cyanomethyl)-3-iodoindole-2-carboxylate Traditional Name: 1-(cyanomethyl)-3-iodo-indole-2-carboxylic acid ethyl ester Formula: C13H11IN2O2 MolecularWeight: 354.14311

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N1CC#N)I

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N1CC#N)I

InChI

InChI=1S/C13H11IN2O2/c1-2-18-13(17)12-11(14)9-5-3-4-6-10(9)16(12)8-7-15/h3-6H,2,8H2,1H3