2-methyl-2-[3-[(1-nitroacridin-9-yl)amino]propylamino]propane-1,3-diol dihydrochloride

Systemtic Name: 2-methyl-2-[3-[(1-nitroacridin-9-yl)amino]propylamino]propane-1,3-diol dihydrochloride Openeye Name: 2-methyl-2-[3-[(1-nitroacridin-9-yl)amino]propylamino]propane-1,3-diol dihydrochloride CAS Name: 2-methyl-2-[3-[(1-nitro-9-acridinyl)amino]propylamino]propane-1,3-diol dihydrochloride IUPAC Name: 2-methyl-2-[3-[(1-nitroacridin-9-yl)amino]propylamino]propane-1,3-diol dihydrochloride Traditional Name: 2-methyl-2-[3-[(1-nitroacridin-9-yl)amino]propylamino]propane-1,3-diol dihydrochloride Formula: C20H26Cl2N4O4 MolecularWeight: 457.35084

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NCCCNC1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-].Cl.Cl

Isomeric SMILES

CC(CO)(CO)NCCCNC1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-].Cl.Cl

InChI

InChI=1S/C20H24N4O4.2ClH/c1-20(12-25,13-26)22-11-5-10-21-19-14-6-2-3-7-15(14)23-16-8-4-9-17(18(16)19)24(27)28;;/h2-4,6-9,22,25-26H,5,10-13H2,1H3,(H,21,23);2*1H