5,6-ditert-butyl-1H-indole-2-carboxylic acid

Systemtic Name: 5,6-ditert-butyl-1H-indole-2-carboxylic acid Openeye Name: 5,6-ditert-butyl-1H-indole-2-carboxylic acid CAS Name: 5,6-ditert-butyl-1H-indole-2-carboxylic acid IUPAC Name: 5,6-ditert-butyl-1H-indole-2-carboxylic acid Traditional Name: 5,6-ditert-butyl-1H-indole-2-carboxylic acid Formula: C17H23NO2 MolecularWeight: 273.37002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C2C(=C1)C=C(N2)C(=O)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=C(C=C2C(=C1)C=C(N2)C(=O)O)C(C)(C)C

InChI

InChI=1S/C17H23NO2/c1-16(2,3)11-7-10-8-14(15(19)20)18-13(10)9-12(11)17(4,5)6/h7-9,18H,1-6H3,(H,19,20)