N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C21H23ClN4O2 MolecularWeight: 398.88592

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=NNC(=O)C2=CC=CC=C21)C3=CC=CC=C3Cl

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=NNC(=O)C2=CC=CC=C21)C3=CC=CC=C3Cl

InChI

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