4-[4-[1-(2-chlorophenyl)ethyl]piperazin-1-yl]carbonyl-2-methyl-phthalazin-1-one

Systemtic Name: 4-[4-[1-(2-chlorophenyl)ethyl]piperazin-1-yl]carbonyl-2-methyl-phthalazin-1-one Openeye Name: 4-[4-[1-(2-chlorophenyl)ethyl]piperazine-1-carbonyl]-2-methyl-phthalazin-1-one CAS Name: 4-[[4-[1-(2-chlorophenyl)ethyl]-1-piperazinyl]-oxomethyl]-2-methyl-1-phthalazinone IUPAC Name: 4-[4-[1-(2-chlorophenyl)ethyl]piperazine-1-carbonyl]-2-methylphthalazin-1-one Traditional Name: 4-[4-[1-(2-chlorophenyl)ethyl]piperazine-1-carbonyl]-2-methyl-phthalazin-1-one Formula: C22H23ClN4O2 MolecularWeight: 410.89662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)N2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C

Isomeric SMILES

CC(C1=CC=CC=C1Cl)N2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C22H23ClN4O2/c1-15(16-7-5-6-10-19(16)23)26-11-13-27(14-12-26)22(29)20-17-8-3-4-9-18(17)21(28)25(2)24-20/h3-10,15H,11-14H2,1-2H3