N-[2-[(4-methylphthalazin-2-ium-1-yl)amino]ethyl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[2-[(4-methylphthalazin-2-ium-1-yl)amino]ethyl]-4-(trifluoromethyl)benzamide Openeye Name: N-[2-[(4-methylphthalazin-2-ium-1-yl)amino]ethyl]-4-(trifluoromethyl)benzamide CAS Name: N-[2-[(4-methyl-1-phthalazin-2-iumyl)amino]ethyl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[2-[(4-methylphthalazin-2-ium-1-yl)amino]ethyl]-4-(trifluoromethyl)benzamide Traditional Name: N-[2-[(4-methylphthalazin-2-ium-1-yl)amino]ethyl]-4-(trifluoromethyl)benzamide Formula: C19H18F3N4O+ MolecularWeight: 375.36763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=N[NH+]=C(C2=CC=CC=C12)NCCNC(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=N[NH+]=C(C2=CC=CC=C12)NCCNC(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H17F3N4O/c1-12-15-4-2-3-5-16(15)17(26-25-12)23-10-11-24-18(27)13-6-8-14(9-7-13)19(20,21)22/h2-9H,10-11H2,1H3,(H,23,26)(H,24,27)/p+1