6-tert-butyl-3-oxidanylidene-1,2-dihydroindene-2-carboxylate

Systemtic Name: 6-tert-butyl-3-oxidanylidene-1,2-dihydroindene-2-carboxylate Openeye Name: 5-tert-butyl-1-oxo-indane-2-carboxylate CAS Name: 6-tert-butyl-3-oxo-1,2-dihydroindene-2-carboxylate IUPAC Name: 6-tert-butyl-3-oxo-1,2-dihydroindene-2-carboxylate Traditional Name: 5-tert-butyl-1-keto-indane-2-carboxylate Formula: C14H15O3- MolecularWeight: 231.2671

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)C(=O)C(C2)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)C(=O)C(C2)C(=O)[O-]

InChI

InChI=1S/C14H16O3/c1-14(2,3)9-4-5-10-8(6-9)7-11(12(10)15)13(16)17/h4-6,11H,7H2,1-3H3,(H,16,17)/p-1