[3-bromanyl-2,4,5,6,6-pentakis(oxidanyl)cyclohexa-2,4-dien-1-yl]-phenyl-methanone

Systemtic Name: [3-bromanyl-2,4,5,6,6-pentakis(oxidanyl)cyclohexa-2,4-dien-1-yl]-phenyl-methanone Openeye Name: (3-bromo-2,4,5,6,6-pentahydroxy-cyclohexa-2,4-dien-1-yl)-phenyl-methanone CAS Name: (3-bromo-2,4,5,6,6-pentahydroxy-1-cyclohexa-2,4-dienyl)-phenylmethanone IUPAC Name: (3-bromo-2,4,5,6,6-pentahydroxycyclohexa-2,4-dien-1-yl)-phenylmethanone Traditional Name: (3-bromo-2,4,5,6,6-pentahydroxy-cyclohexa-2,4-dien-1-yl)-phenyl-methanone Formula: C13H11BrO6 MolecularWeight: 343.12684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11BrO6/c14-8-10(16)7(13(19,20)12(18)11(8)17)9(15)6-4-2-1-3-5-6/h1-5,7,16-20H