4-[2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one

Systemtic Name: 4-[2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one Openeye Name: 4-[2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-oxo-ethyl]-2H-phthalazin-1-one CAS Name: 4-[2-[4-[(2-fluorophenyl)methyl]-1-piperazinyl]-2-oxoethyl]-2H-phthalazin-1-one IUPAC Name: 4-[2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-oxoethyl]-2H-phthalazin-1-one Traditional Name: 4-[2-[4-(2-fluorobenzyl)piperazino]-2-keto-ethyl]-2H-phthalazin-1-one Formula: C21H21FN4O2 MolecularWeight: 380.415443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2F)C(=O)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2F)C(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H21FN4O2/c22-18-8-4-1-5-15(18)14-25-9-11-26(12-10-25)20(27)13-19-16-6-2-3-7-17(16)21(28)24-23-19/h1-8H,9-14H2,(H,24,28)