2-(2-oxidanylidenepropyl)-3-(2-oxidanylpropan-2-yl)naphthalene-1,4-dione

Systemtic Name: 2-(2-oxidanylidenepropyl)-3-(2-oxidanylpropan-2-yl)naphthalene-1,4-dione Openeye Name: 2-acetonyl-3-(1-hydroxy-1-methyl-ethyl)naphthalene-1,4-dione CAS Name: 2-(2-hydroxypropan-2-yl)-3-(2-oxopropyl)naphthalene-1,4-dione IUPAC Name: 2-(2-hydroxypropan-2-yl)-3-(2-oxopropyl)naphthalene-1,4-dione Traditional Name: 2-acetonyl-3-(1-hydroxy-1-methyl-ethyl)-1,4-naphthoquinone Formula: C16H16O4 MolecularWeight: 272.29584

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=C(C(=O)C2=CC=CC=C2C1=O)C(C)(C)O

Isomeric SMILES

CC(=O)CC1=C(C(=O)C2=CC=CC=C2C1=O)C(C)(C)O

InChI

InChI=1S/C16H16O4/c1-9(17)8-12-13(16(2,3)20)15(19)11-7-5-4-6-10(11)14(12)18/h4-7,20H,8H2,1-3H3