(2-chloranyl-5-nitro-phenyl)methyl-methyl-[(1-oxidanylidenephthalazin-2-yl)methyl]azanium

Systemtic Name: (2-chloranyl-5-nitro-phenyl)methyl-methyl-[(1-oxidanylidenephthalazin-2-yl)methyl]azanium Openeye Name: (2-chloro-5-nitro-phenyl)methyl-methyl-[(1-oxophthalazin-2-yl)methyl]ammonium CAS Name: (2-chloro-5-nitrophenyl)methyl-methyl-[(1-oxo-2-phthalazinyl)methyl]ammonium IUPAC Name: (2-chloro-5-nitrophenyl)methyl-methyl-[(1-oxophthalazin-2-yl)methyl]azanium Traditional Name: (2-chloro-5-nitro-benzyl)-[(1-ketophthalazin-2-yl)methyl]-methyl-ammonium Formula: C17H16ClN4O3+ MolecularWeight: 359.78694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CN2C(=O)C3=CC=CC=C3C=N2

Isomeric SMILES

C[NH+](CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CN2C(=O)C3=CC=CC=C3C=N2

InChI

InChI=1S/C17H15ClN4O3/c1-20(10-13-8-14(22(24)25)6-7-16(13)18)11-21-17(23)15-5-3-2-4-12(15)9-19-21/h2-9H,10-11H2,1H3/p+1