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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)C)C3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)C)C3=CC=CC=C3

InChI

InChI=1S/C23H28N4O2/c1-4-26(5-2)21(18-11-7-6-8-12-18)15-24-22(28)16-27-23(29)20-14-10-9-13-19(20)17(3)25-27/h6-14,21H,4-5,15-16H2,1-3H3,(H,24,28)/p+1/t21-/m1/s1