2-[5-(diethylamino)pentan-2-yl-methyl-amino]anthracene-9,10-dione; phosphono dihydrogen phosphate

Systemtic Name: 2-[5-(diethylamino)pentan-2-yl-methyl-amino]anthracene-9,10-dione; phosphono dihydrogen phosphate Openeye Name: 2-[[4-(diethylamino)-1-methyl-butyl]-methyl-amino]anthracene-9,10-dione; phosphono dihydrogen phosphate CAS Name: 2-[5-(diethylamino)pentan-2-yl-methylamino]anthracene-9,10-dione; phosphono dihydrogen phosphate IUPAC Name: 2-[5-(diethylamino)pentan-2-yl-methylamino]anthracene-9,10-dione; phosphono dihydrogen phosphate Traditional Name: 2-[[4-(diethylamino)-1-methyl-butyl]-methyl-amino]-9,10-anthraquinone; phosphono dihydrogen phosphate Formula: C24H34N2O9P2 MolecularWeight: 556.482282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N2O2.H4O7P2/c1-5-26(6-2)15-9-10-17(3)25(4)18-13-14-21-22(16-18)24(28)20-12-8-7-11-19(20)23(21)27;1-8(2,3)7-9(4,5)6/h7-8,11-14,16-17H,5-6,9-10,15H2,1-4H3;(H2,1,2,3)(H2,4,5,6)