3-tert-butyl-1H-indole-2-carboxylic acid

Systemtic Name: 3-tert-butyl-1H-indole-2-carboxylic acid Openeye Name: 3-tert-butyl-1H-indole-2-carboxylic acid CAS Name: 3-tert-butyl-1H-indole-2-carboxylic acid IUPAC Name: 3-tert-butyl-1H-indole-2-carboxylic acid Traditional Name: 3-tert-butyl-1H-indole-2-carboxylic acid Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(NC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CC(C)(C)C1=C(NC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C13H15NO2/c1-13(2,3)10-8-6-4-5-7-9(8)14-11(10)12(15)16/h4-7,14H,1-3H3,(H,15,16)