3-(2-methyl-2-oxidanyl-propanoyl)benzo[b][1]benzoxepine-5,6-dione

Systemtic Name: 3-(2-methyl-2-oxidanyl-propanoyl)benzo[b][1]benzoxepine-5,6-dione Openeye Name: 3-(2-hydroxy-2-methyl-propanoyl)benzo[b][1]benzoxepine-5,6-dione CAS Name: 3-(2-hydroxy-2-methyl-1-oxopropyl)benzo[b][1]benzoxepin-5,6-dione IUPAC Name: 3-(2-hydroxy-2-methylpropanoyl)benzo[b][1]benzoxepine-5,6-dione Traditional Name: 3-(2-hydroxy-2-methyl-propanoyl)benzo[b][1]benzoxepin-5,6-quinone Formula: C18H14O5 MolecularWeight: 310.30076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C1=CC2=C(C=C1)OC3=CC=CC=C3C(=O)C2=O)O

Isomeric SMILES

CC(C)(C(=O)C1=CC2=C(C=C1)OC3=CC=CC=C3C(=O)C2=O)O

InChI

InChI=1S/C18H14O5/c1-18(2,22)17(21)10-7-8-14-12(9-10)16(20)15(19)11-5-3-4-6-13(11)23-14/h3-9,22H,1-2H3