[3-butyl-4,4,5,6,6-pentakis(oxidanyl)cyclohex-2-en-1-yl]-phenyl-methanone

Systemtic Name: [3-butyl-4,4,5,6,6-pentakis(oxidanyl)cyclohex-2-en-1-yl]-phenyl-methanone Openeye Name: (3-butyl-4,4,5,6,6-pentahydroxy-cyclohex-2-en-1-yl)-phenyl-methanone CAS Name: (3-butyl-4,4,5,6,6-pentahydroxy-1-cyclohex-2-enyl)-phenylmethanone IUPAC Name: (3-butyl-4,4,5,6,6-pentahydroxycyclohex-2-en-1-yl)-phenylmethanone Traditional Name: (3-butyl-4,4,5,6,6-pentahydroxy-cyclohex-2-en-1-yl)-phenyl-methanone Formula: C17H22O6 MolecularWeight: 322.35298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(C(C(C1(O)O)O)(O)O)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC1=CC(C(C(C1(O)O)O)(O)O)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H22O6/c1-2-3-9-12-10-13(14(18)11-7-5-4-6-8-11)17(22,23)15(19)16(12,20)21/h4-8,10,13,15,19-23H,2-3,9H2,1H3