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

Systemtic Name: 4-[2-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one Openeye Name: 4-[2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]-2-oxo-ethyl]-2H-phthalazin-1-one CAS Name: 4-[2-[4-[2-(4-chlorophenoxy)ethyl]-1-piperazinyl]-2-oxoethyl]-2H-phthalazin-1-one IUPAC Name: 4-[2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]-2-oxoethyl]-2H-phthalazin-1-one Traditional Name: 4-[2-[4-[2-(4-chlorophenoxy)ethyl]piperazino]-2-keto-ethyl]-2H-phthalazin-1-one Formula: C22H23ClN4O3 MolecularWeight: 426.89602

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=C(C=C2)Cl)C(=O)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1CCOC2=CC=C(C=C2)Cl)C(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C22H23ClN4O3/c23-16-5-7-17(8-6-16)30-14-13-26-9-11-27(12-10-26)21(28)15-20-18-3-1-2-4-19(18)22(29)25-24-20/h1-8H,9-15H2,(H,25,29)