disodium [(4-methoxyphenyl)sulfanyl-(10-methylacridin-9-ylidene)methyl] phosphate

Systemtic Name: disodium [(4-methoxyphenyl)sulfanyl-(10-methylacridin-9-ylidene)methyl] phosphate Openeye Name: disodium [(4-methoxyphenyl)sulfanyl-(10-methylacridin-9-ylidene)methyl] phosphate CAS Name: disodium [[(4-methoxyphenyl)thio]-(10-methyl-9-acridinylidene)methyl] phosphate IUPAC Name: disodium [(4-methoxyphenyl)sulfanyl-(10-methylacridin-9-ylidene)methyl] phosphate Traditional Name: disodium [[(4-methoxyphenyl)thio]-(10-methylacridin-9-ylidene)methyl] phosphate Formula: C22H18NNa2O5PS MolecularWeight: 485.400321

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C(OP(=O)([O-])[O-])SC3=CC=C(C=C3)OC)C4=CC=CC=C41.[Na+].[Na+]

Isomeric SMILES

CN1C2=CC=CC=C2C(=C(OP(=O)([O-])[O-])SC3=CC=C(C=C3)OC)C4=CC=CC=C41.[Na+].[Na+]

InChI

InChI=1S/C22H20NO5PS.2Na/c1-23-19-9-5-3-7-17(19)21(18-8-4-6-10-20(18)23)22(28-29(24,25)26)30-16-13-11-15(27-2)12-14-16;;/h3-14H,1-2H3,(H2,24,25,26);;/q;2*+1/p-2