diethyl-[(2S)-1-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]-3-phenyl-propan-2-yl]azanium

Systemtic Name: diethyl-[(2S)-1-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]-3-phenyl-propan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-2-[(4-oxo-3H-phthalazine-1-carbonyl)amino]ethyl]-diethyl-ammonium CAS Name: diethyl-[(2S)-1-[[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]amino]-3-phenylpropan-2-yl]ammonium IUPAC Name: diethyl-[(2S)-1-[(4-oxo-3H-phthalazine-1-carbonyl)amino]-3-phenylpropan-2-yl]azanium Traditional Name: [(1S)-1-benzyl-2-[(4-keto-3H-phthalazine-1-carbonyl)amino]ethyl]-diethyl-ammonium Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CC1=CC=CC=C1)CNC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC[NH+](CC)[C@@H](CC1=CC=CC=C1)CNC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C22H26N4O2/c1-3-26(4-2)17(14-16-10-6-5-7-11-16)15-23-22(28)20-18-12-8-9-13-19(18)21(27)25-24-20/h5-13,17H,3-4,14-15H2,1-2H3,(H,23,28)(H,25,27)/p+1/t17-/m0/s1