disodium [3-(4-acridin-9-ylcarbonylpiperazin-1-yl)phenyl] phosphate

Systemtic Name: disodium [3-(4-acridin-9-ylcarbonylpiperazin-1-yl)phenyl] phosphate Openeye Name: disodium [3-[4-(acridine-9-carbonyl)piperazin-1-yl]phenyl] phosphate CAS Name: disodium [3-[4-[9-acridinyl(oxo)methyl]-1-piperazinyl]phenyl] phosphate IUPAC Name: disodium [3-[4-(acridine-9-carbonyl)piperazin-1-yl]phenyl] phosphate Traditional Name: disodium [3-[4-(acridine-9-carbonyl)piperazino]phenyl] phosphate Formula: C24H20N3Na2O5P MolecularWeight: 507.386001

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)OP(=O)([O-])[O-])C(=O)C3=C4C=CC=CC4=NC5=CC=CC=C53.[Na+].[Na+]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)OP(=O)([O-])[O-])C(=O)C3=C4C=CC=CC4=NC5=CC=CC=C53.[Na+].[Na+]

InChI

InChI=1S/C24H22N3O5P.2Na/c28-24(23-19-8-1-3-10-21(19)25-22-11-4-2-9-20(22)23)27-14-12-26(13-15-27)17-6-5-7-18(16-17)32-33(29,30)31;;/h1-11,16H,12-15H2,(H2,29,30,31);;/q;2*+1/p-2