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

Systemtic Name: 6-tert-butyl-1H-indole-2-carboxylic acid Openeye Name: 6-tert-butyl-1H-indole-2-carboxylic acid CAS Name: 6-tert-butyl-1H-indole-2-carboxylic acid IUPAC Name: 6-tert-butyl-1H-indole-2-carboxylic acid Traditional Name: 6-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=CC2=C(C=C1)C=C(N2)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)C=C(N2)C(=O)O

InChI

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