6-(hydroxymethyl)-2-methoxy-5,8-bis(oxidanyl)-7-(2-oxidanylidenepropyl)naphthalene-1,4-dione

Systemtic Name: 6-(hydroxymethyl)-2-methoxy-5,8-bis(oxidanyl)-7-(2-oxidanylidenepropyl)naphthalene-1,4-dione Openeye Name: 7-acetonyl-5,8-dihydroxy-6-(hydroxymethyl)-2-methoxy-naphthalene-1,4-dione CAS Name: 5,8-dihydroxy-6-(hydroxymethyl)-2-methoxy-7-(2-oxopropyl)naphthalene-1,4-dione IUPAC Name: 5,8-dihydroxy-6-(hydroxymethyl)-2-methoxy-7-(2-oxopropyl)naphthalene-1,4-dione Traditional Name: 7-acetonyl-5,8-dihydroxy-2-methoxy-6-methylol-1,4-naphthoquinone Formula: C15H14O7 MolecularWeight: 306.26746

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=C(C2=C(C(=O)C=C(C2=O)OC)C(=C1CO)O)O

Isomeric SMILES

CC(=O)CC1=C(C2=C(C(=O)C=C(C2=O)OC)C(=C1CO)O)O

InChI

InChI=1S/C15H14O7/c1-6(17)3-7-8(5-16)14(20)11-9(18)4-10(22-2)15(21)12(11)13(7)19/h4,16,19-20H,3,5H2,1-2H3