4-azanylnaphthalene-1,2-dione hydrate

Systemtic Name: 4-azanylnaphthalene-1,2-dione hydrate Openeye Name: 4-aminonaphthalene-1,2-dione hydrate CAS Name: 4-aminonaphthalene-1,2-dione hydrate IUPAC Name: 4-aminonaphthalene-1,2-dione hydrate Traditional Name: 4-amino-1,2-naphthoquinone hydrate Formula: C20H16N2O5 MolecularWeight: 364.35144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C10H7NO2.H2O/c2*11-8-5-9(12)10(13)7-4-2-1-3-6(7)8;/h2*1-5H,11H2;1H2