3-(2-hydroxyethyl)-2-methyl-5-oxidanyl-naphthalene-1,4-dione

Systemtic Name: 3-(2-hydroxyethyl)-2-methyl-5-oxidanyl-naphthalene-1,4-dione Openeye Name: 5-hydroxy-3-(2-hydroxyethyl)-2-methyl-naphthalene-1,4-dione CAS Name: 5-hydroxy-3-(2-hydroxyethyl)-2-methylnaphthalene-1,4-dione IUPAC Name: 5-hydroxy-3-(2-hydroxyethyl)-2-methylnaphthalene-1,4-dione Traditional Name: 5-hydroxy-3-(2-hydroxyethyl)-2-methyl-1,4-naphthoquinone Formula: C13H12O4 MolecularWeight: 232.23198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(C1=O)C=CC=C2O)CCO

Isomeric SMILES

CC1=C(C(=O)C2=C(C1=O)C=CC=C2O)CCO

InChI

InChI=1S/C13H12O4/c1-7-8(5-6-14)13(17)11-9(12(7)16)3-2-4-10(11)15/h2-4,14-15H,5-6H2,1H3