[4-(1-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-yl)phenyl]methyl 2,2-dimethylpropanoate

Systemtic Name: [4-(1-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-yl)phenyl]methyl 2,2-dimethylpropanoate Openeye Name: [4-(1-hydroxy-4-oxo-cyclohexa-2,5-dien-1-yl)phenyl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-(1-hydroxy-4-oxo-1-cyclohexa-2,5-dienyl)phenyl]methyl ester IUPAC Name: [4-(1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl)phenyl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-(1-hydroxy-4-keto-cyclohexa-2,5-dien-1-yl)benzyl] ester Formula: C18H20O4 MolecularWeight: 300.349

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCC1=CC=C(C=C1)C2(C=CC(=O)C=C2)O

Isomeric SMILES

CC(C)(C)C(=O)OCC1=CC=C(C=C1)C2(C=CC(=O)C=C2)O

InChI

InChI=1S/C18H20O4/c1-17(2,3)16(20)22-12-13-4-6-14(7-5-13)18(21)10-8-15(19)9-11-18/h4-11,21H,12H2,1-3H3