dipotassium 6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2H-phthalazin-1-one sulfate

Systemtic Name: dipotassium 6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2H-phthalazin-1-one sulfate Openeye Name: dipotassium 6-[(E)-2-(4-hydroxyphenyl)vinyl]-2H-phthalazin-1-one sulfate CAS Name: dipotassium 6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2H-phthalazin-1-one sulfate IUPAC Name: dipotassium 6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2H-phthalazin-1-one sulfate Traditional Name: dipotassium 6-[(E)-2-(4-hydroxyphenyl)vinyl]-2H-phthalazin-1-one sulfate Formula: C16H12K2N2O6S MolecularWeight: 438.53788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC2=CC3=C(C=C2)C(=O)NN=C3)O.[O-]S(=O)(=O)[O-].[K+].[K+]

Isomeric SMILES

C1=CC(=CC=C1/C=C/C2=CC3=C(C=C2)C(=O)NN=C3)O.[O-]S(=O)(=O)[O-].[K+].[K+]

InChI

InChI=1S/C16H12N2O2.2K.H2O4S/c19-14-6-3-11(4-7-14)1-2-12-5-8-15-13(9-12)10-17-18-16(15)20;;;1-5(2,3)4/h1-10,19H,(H,18,20);;;(H2,1,2,3,4)/q;2*+1;/p-2/b2-1+;;;