6,8-ditert-butyl-4-oxidanylidene-chromene-2-carboxylic acid; sodium

Systemtic Name: 6,8-ditert-butyl-4-oxidanylidene-chromene-2-carboxylic acid; sodium Openeye Name: 6,8-ditert-butyl-4-oxo-chromene-2-carboxylic acid; sodium CAS Name: 6,8-ditert-butyl-4-oxo-1-benzopyran-2-carboxylic acid; sodium IUPAC Name: 6,8-ditert-butyl-4-oxochromene-2-carboxylic acid; sodium Traditional Name: 6,8-ditert-butyl-4-keto-chromene-2-carboxylic acid; sodium Formula: C18H22NaO4 MolecularWeight: 325.35465

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C1)C(=O)C=C(O2)C(=O)O)C(C)(C)C.[Na]

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C1)C(=O)C=C(O2)C(=O)O)C(C)(C)C.[Na]

InChI

InChI=1S/C18H22O4.Na/c1-17(2,3)10-7-11-13(19)9-14(16(20)21)22-15(11)12(8-10)18(4,5)6;/h7-9H,1-6H3,(H,20,21);