[(1R)-1-(2-chlorophenyl)-2-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-1-(2-chlorophenyl)-2-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]ethyl]-dimethyl-azanium Openeye Name: [(1R)-1-(2-chlorophenyl)-2-[(3-ethyl-4-oxo-phthalazine-1-carbonyl)amino]ethyl]-dimethyl-ammonium CAS Name: [(1R)-1-(2-chlorophenyl)-2-[[(3-ethyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1R)-1-(2-chlorophenyl)-2-[(3-ethyl-4-oxophthalazine-1-carbonyl)amino]ethyl]-dimethylazanium Traditional Name: [(1R)-1-(2-chlorophenyl)-2-[(3-ethyl-4-keto-phthalazine-1-carbonyl)amino]ethyl]-dimethyl-ammonium Formula: C21H24ClN4O2+ MolecularWeight: 399.89386

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(C3=CC=CC=C3Cl)[NH+](C)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC[C@@H](C3=CC=CC=C3Cl)[NH+](C)C

InChI

InChI=1S/C21H23ClN4O2/c1-4-26-21(28)15-10-6-5-9-14(15)19(24-26)20(27)23-13-18(25(2)3)16-11-7-8-12-17(16)22/h5-12,18H,4,13H2,1-3H3,(H,23,27)/p+1/t18-/m0/s1