3-[4-[[2-[[3-(2,5-dinitrophenoxy)-2-oxidanyl-propyl]amino]-2-methyl-propyl]amino]phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[4-[[2-[[3-(2,5-dinitrophenoxy)-2-oxidanyl-propyl]amino]-2-methyl-propyl]amino]phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[4-[[2-[[3-(2,5-dinitrophenoxy)-2-hydroxy-propyl]amino]-2-methyl-propyl]amino]phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[4-[[2-[[3-(2,5-dinitrophenoxy)-2-hydroxypropyl]amino]-2-methylpropyl]amino]phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[4-[[2-[[3-(2,5-dinitrophenoxy)-2-hydroxypropyl]amino]-2-methylpropyl]amino]phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-[4-[[2-[[3-(2,5-dinitrophenoxy)-2-hydroxy-propyl]amino]-2-methyl-propyl]amino]phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one Formula: C24H30N6O7 MolecularWeight: 514.531

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN=C1C2=CC=C(C=C2)NCC(C)(C)NCC(COC3=C(C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])O

Isomeric SMILES

CC1CC(=O)NN=C1C2=CC=C(C=C2)NCC(C)(C)NCC(COC3=C(C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])O

InChI

InChI=1S/C24H30N6O7/c1-15-10-22(32)27-28-23(15)16-4-6-17(7-5-16)25-14-24(2,3)26-12-19(31)13-37-21-11-18(29(33)34)8-9-20(21)30(35)36/h4-9,11,15,19,25-26,31H,10,12-14H2,1-3H3,(H,27,32)