5-cyano-1-ethyl-indole-2-carboxylic acid

Systemtic Name: 5-cyano-1-ethyl-indole-2-carboxylic acid Openeye Name: 5-cyano-1-ethyl-indole-2-carboxylic acid CAS Name: 5-cyano-1-ethyl-2-indolecarboxylic acid IUPAC Name: 5-cyano-1-ethylindole-2-carboxylic acid Traditional Name: 5-cyano-1-ethyl-indole-2-carboxylic acid Formula: C12H10N2O2 MolecularWeight: 214.22

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C#N)C=C1C(=O)O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C#N)C=C1C(=O)O

InChI

InChI=1S/C12H10N2O2/c1-2-14-10-4-3-8(7-13)5-9(10)6-11(14)12(15)16/h3-6H,2H2,1H3,(H,15,16)