N-methyl-N'-(1-nitroacridin-9-yl)propane-1,3-diamine dihydrochloride

Systemtic Name: N-methyl-N'-(1-nitroacridin-9-yl)propane-1,3-diamine dihydrochloride Openeye Name: N-methyl-N'-(1-nitroacridin-9-yl)propane-1,3-diamine dihydrochloride CAS Name: N-methyl-N'-(1-nitro-9-acridinyl)propane-1,3-diamine dihydrochloride IUPAC Name: N-methyl-N'-(1-nitroacridin-9-yl)propane-1,3-diamine dihydrochloride Traditional Name: methyl-[3-[(1-nitroacridin-9-yl)amino]propyl]amine dihydrochloride Formula: C17H20Cl2N4O2 MolecularWeight: 383.2723

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCNC1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-].Cl.Cl

Isomeric SMILES

CNCCCNC1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-].Cl.Cl

InChI

InChI=1S/C17H18N4O2.2ClH/c1-18-10-5-11-19-17-12-6-2-3-7-13(12)20-14-8-4-9-15(16(14)17)21(22)23;;/h2-4,6-9,18H,5,10-11H2,1H3,(H,19,20);2*1H