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

Systemtic Name: [3,4,5,6,6-pentakis(oxidanyl)-3-propyl-cyclohexa-1,4-dien-1-yl]-phenyl-methanone Openeye Name: (3,4,5,6,6-pentahydroxy-3-propyl-cyclohexa-1,4-dien-1-yl)-phenyl-methanone CAS Name: (3,4,5,6,6-pentahydroxy-3-propyl-1-cyclohexa-1,4-dienyl)-phenylmethanone IUPAC Name: (3,4,5,6,6-pentahydroxy-3-propylcyclohexa-1,4-dien-1-yl)-phenylmethanone Traditional Name: (3,4,5,6,6-pentahydroxy-3-propyl-cyclohexa-1,4-dien-1-yl)-phenyl-methanone Formula: C16H18O6 MolecularWeight: 306.31052

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C=C(C(C(=C1O)O)(O)O)C(=O)C2=CC=CC=C2)O

Isomeric SMILES

CCCC1(C=C(C(C(=C1O)O)(O)O)C(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C16H18O6/c1-2-8-15(20)9-11(16(21,22)14(19)13(15)18)12(17)10-6-4-3-5-7-10/h3-7,9,18-22H,2,8H2,1H3