naphthalene-1,4-dione hydrate

Systemtic Name: naphthalene-1,4-dione hydrate Openeye Name: naphthalene-1,4-dione hydrate CAS Name: naphthalene-1,4-dione hydrate IUPAC Name: naphthalene-1,4-dione hydrate Traditional Name: 1,4-naphthoquinone hydrate Formula: C20H14O5 MolecularWeight: 334.32216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=O)C=CC(=O)C2=C1.C1=CC=C2C(=O)C=CC(=O)C2=C1.O

Isomeric SMILES

C1=CC=C2C(=O)C=CC(=O)C2=C1.C1=CC=C2C(=O)C=CC(=O)C2=C1.O

InChI

InChI=1S/2C10H6O2.H2O/c2*11-9-5-6-10(12)8-4-2-1-3-7(8)9;/h2*1-6H;1H2