diethyl-[[4-[[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoylamino]methyl]phenyl]methyl]azanium

Systemtic Name: diethyl-[[4-[[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoylamino]methyl]phenyl]methyl]azanium Openeye Name: diethyl-[[4-[[[2-(3-methyl-4-oxo-phthalazin-1-yl)acetyl]amino]methyl]phenyl]methyl]ammonium CAS Name: diethyl-[[4-[[[2-(3-methyl-4-oxo-1-phthalazinyl)-1-oxoethyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: diethyl-[[4-[[[2-(3-methyl-4-oxophthalazin-1-yl)acetyl]amino]methyl]phenyl]methyl]azanium Traditional Name: diethyl-[4-[[[2-(4-keto-3-methyl-phthalazin-1-yl)acetyl]amino]methyl]benzyl]ammonium Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C23H28N4O2/c1-4-27(5-2)16-18-12-10-17(11-13-18)15-24-22(28)14-21-19-8-6-7-9-20(19)23(29)26(3)25-21/h6-13H,4-5,14-16H2,1-3H3,(H,24,28)/p+1