6-(2,2-dimethylpropanoyl)-5-oxidanyl-benzo[7]annulen-7-one

Systemtic Name: 6-(2,2-dimethylpropanoyl)-5-oxidanyl-benzo[7]annulen-7-one Openeye Name: 6-(2,2-dimethylpropanoyl)-5-hydroxy-benzo[7]annulen-7-one CAS Name: 6-(2,2-dimethyl-1-oxopropyl)-5-hydroxy-7-benzo[7]annulenone IUPAC Name: 6-(2,2-dimethylpropanoyl)-5-hydroxybenzo[7]annulen-7-one Traditional Name: 5-hydroxy-6-pivaloyl-benzocyclohepten-7-one Formula: C16H16O3 MolecularWeight: 256.29644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C1=C(C2=CC=CC=C2C=CC1=O)O

Isomeric SMILES

CC(C)(C)C(=O)C1=C(C2=CC=CC=C2C=CC1=O)O

InChI

InChI=1S/C16H16O3/c1-16(2,3)15(19)13-12(17)9-8-10-6-4-5-7-11(10)14(13)18/h4-9,18H,1-3H3