2-[3-[(4-cyanophenyl)methyl]-4-oxidanylidene-phthalazin-1-yl]-N,N-diethyl-ethanamide

Systemtic Name: 2-[3-[(4-cyanophenyl)methyl]-4-oxidanylidene-phthalazin-1-yl]-N,N-diethyl-ethanamide Openeye Name: 2-[3-[(4-cyanophenyl)methyl]-4-oxo-phthalazin-1-yl]-N,N-diethyl-acetamide CAS Name: 2-[3-[(4-cyanophenyl)methyl]-4-oxo-1-phthalazinyl]-N,N-diethylacetamide IUPAC Name: 2-[3-[(4-cyanophenyl)methyl]-4-oxophthalazin-1-yl]-N,N-diethylacetamide Traditional Name: 2-[3-(4-cyanobenzyl)-4-keto-phthalazin-1-yl]-N,N-diethyl-acetamide Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CC1=NN(C(=O)C2=CC=CC=C21)CC3=CC=C(C=C3)C#N

Isomeric SMILES

CCN(CC)C(=O)CC1=NN(C(=O)C2=CC=CC=C21)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H22N4O2/c1-3-25(4-2)21(27)13-20-18-7-5-6-8-19(18)22(28)26(24-20)15-17-11-9-16(14-23)10-12-17/h5-12H,3-4,13,15H2,1-2H3