10-imidazol-1-yl-10-(4-methylphenyl)anthracen-9-one diphosphate

Systemtic Name: 10-imidazol-1-yl-10-(4-methylphenyl)anthracen-9-one diphosphate Openeye Name: 10-imidazol-1-yl-10-(p-tolyl)anthracen-9-one diphosphate CAS Name: 10-(1-imidazolyl)-10-(4-methylphenyl)-9-anthracenone diphosphate IUPAC Name: 10-imidazol-1-yl-10-(4-methylphenyl)anthracen-9-one diphosphate Traditional Name: 10-imidazol-1-yl-10-(p-tolyl)anthracen-9-one diphosphate Formula: C24H18N2O9P2-6 MolecularWeight: 540.355242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)C4=CC=CC=C42)N5C=CN=C5.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)C4=CC=CC=C42)N5C=CN=C5.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C24H18N2O.2H3O4P/c1-17-10-12-18(13-11-17)24(26-15-14-25-16-26)21-8-4-2-6-19(21)23(27)20-7-3-5-9-22(20)24;2*1-5(2,3)4/h2-16H,1H3;2*(H3,1,2,3,4)/p-6