3,5-ditert-butyl-4-methanoyl-benzoic acid

Systemtic Name: 3,5-ditert-butyl-4-methanoyl-benzoic acid Openeye Name: 3,5-ditert-butyl-4-formyl-benzoic acid CAS Name: 3,5-ditert-butyl-4-formylbenzoic acid IUPAC Name: 3,5-ditert-butyl-4-formylbenzoic acid Traditional Name: 3,5-ditert-butyl-4-formyl-benzoic acid Formula: C16H22O3 MolecularWeight: 262.34408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1C=O)C(C)(C)C)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1C=O)C(C)(C)C)C(=O)O

InChI

InChI=1S/C16H22O3/c1-15(2,3)12-7-10(14(18)19)8-13(11(12)9-17)16(4,5)6/h7-9H,1-6H3,(H,18,19)