methyl 1-(phenylcarbonyl)-4-(4-phenylphthalazin-1-yl)piperazine-2-carboxylate

Systemtic Name: methyl 1-(phenylcarbonyl)-4-(4-phenylphthalazin-1-yl)piperazine-2-carboxylate Openeye Name: methyl 1-benzoyl-4-(4-phenylphthalazin-1-yl)piperazine-2-carboxylate CAS Name: 1-benzoyl-4-(4-phenyl-1-phthalazinyl)-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 1-benzoyl-4-(4-phenylphthalazin-1-yl)piperazine-2-carboxylate Traditional Name: 1-benzoyl-4-(4-phenylphthalazin-1-yl)piperazine-2-carboxylic acid methyl ester Formula: C27H24N4O3 MolecularWeight: 452.50446

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCN1C(=O)C2=CC=CC=C2)C3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1CN(CCN1C(=O)C2=CC=CC=C2)C3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H24N4O3/c1-34-27(33)23-18-30(16-17-31(23)26(32)20-12-6-3-7-13-20)25-22-15-9-8-14-21(22)24(28-29-25)19-10-4-2-5-11-19/h2-15,23H,16-18H2,1H3