[6-[3,5-bis(chloranyl)-4-methyl-phenyl]pyridazin-3-yl] 4-phenylpiperazine-1-carboxylate

Systemtic Name: [6-[3,5-bis(chloranyl)-4-methyl-phenyl]pyridazin-3-yl] 4-phenylpiperazine-1-carboxylate Openeye Name: [6-(3,5-dichloro-4-methyl-phenyl)pyridazin-3-yl] 4-phenylpiperazine-1-carboxylate CAS Name: 4-phenyl-1-piperazinecarboxylic acid [6-(3,5-dichloro-4-methylphenyl)-3-pyridazinyl] ester IUPAC Name: [6-(3,5-dichloro-4-methylphenyl)pyridazin-3-yl] 4-phenylpiperazine-1-carboxylate Traditional Name: 4-phenylpiperazine-1-carboxylic acid [6-(3,5-dichloro-4-methyl-phenyl)pyridazin-3-yl] ester Formula: C22H20Cl2N4O2 MolecularWeight: 443.3258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1Cl)C2=NN=C(C=C2)OC(=O)N3CCN(CC3)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1Cl)C2=NN=C(C=C2)OC(=O)N3CCN(CC3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C22H20Cl2N4O2/c1-15-18(23)13-16(14-19(15)24)20-7-8-21(26-25-20)30-22(29)28-11-9-27(10-12-28)17-5-3-2-4-6-17/h2-8,13-14H,9-12H2,1H3