dimethyl-[3-[[2-nitro-4-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]amino]propyl]azanium

Systemtic Name: dimethyl-[3-[[2-nitro-4-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]amino]propyl]azanium Openeye Name: dimethyl-[3-[2-nitro-4-(4-oxo-3H-phthalazin-1-yl)anilino]propyl]ammonium CAS Name: dimethyl-[3-[2-nitro-4-(4-oxo-3H-phthalazin-1-yl)anilino]propyl]ammonium IUPAC Name: dimethyl-[3-[2-nitro-4-(4-oxo-3H-phthalazin-1-yl)anilino]propyl]azanium Traditional Name: 3-[4-(4-keto-3H-phthalazin-1-yl)-2-nitro-anilino]propyl-dimethyl-ammonium Formula: C19H22N5O3+ MolecularWeight: 368.40968

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=C(C=C(C=C1)C2=NNC(=O)C3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)CCCNC1=C(C=C(C=C1)C2=NNC(=O)C3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O3/c1-23(2)11-5-10-20-16-9-8-13(12-17(16)24(26)27)18-14-6-3-4-7-15(14)19(25)22-21-18/h3-4,6-9,12,20H,5,10-11H2,1-2H3,(H,22,25)/p+1