2-[[3-(diethylamino)propylamino]methyl]anthracene-9,10-dione; phosphoric acid

Systemtic Name: 2-[[3-(diethylamino)propylamino]methyl]anthracene-9,10-dione; phosphoric acid Openeye Name: 2-[[3-(diethylamino)propylamino]methyl]anthracene-9,10-dione; phosphoric acid CAS Name: 2-[[3-(diethylamino)propylamino]methyl]anthracene-9,10-dione; phosphoric acid IUPAC Name: 2-[[3-(diethylamino)propylamino]methyl]anthracene-9,10-dione; phosphoric acid Traditional Name: 2-[[3-(diethylamino)propylamino]methyl]-9,10-anthraquinone; phosphoric acid Formula: C22H32N2O10P2 MolecularWeight: 546.444402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNCC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O.OP(=O)(O)O.OP(=O)(O)O

Isomeric SMILES

CCN(CC)CCCNCC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O.OP(=O)(O)O.OP(=O)(O)O

InChI

InChI=1S/C22H26N2O2.2H3O4P/c1-3-24(4-2)13-7-12-23-15-16-10-11-19-20(14-16)22(26)18-9-6-5-8-17(18)21(19)25;2*1-5(2,3)4/h5-6,8-11,14,23H,3-4,7,12-13,15H2,1-2H3;2*(H3,1,2,3,4)