propan-2-yl 4-[2-[4-[3,6-bis(chloranyl)pyridazin-4-yl]piperazin-1-yl]ethoxy]benzoate

Systemtic Name: propan-2-yl 4-[2-[4-[3,6-bis(chloranyl)pyridazin-4-yl]piperazin-1-yl]ethoxy]benzoate Openeye Name: isopropyl 4-[2-[4-(3,6-dichloropyridazin-4-yl)piperazin-1-yl]ethoxy]benzoate CAS Name: 4-[2-[4-(3,6-dichloro-4-pyridazinyl)-1-piperazinyl]ethoxy]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[2-[4-(3,6-dichloropyridazin-4-yl)piperazin-1-yl]ethoxy]benzoate Traditional Name: 4-[2-[4-(3,6-dichloropyridazin-4-yl)piperazino]ethoxy]benzoic acid isopropyl ester Formula: C20H24Cl2N4O3 MolecularWeight: 439.33556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)OCCN2CCN(CC2)C3=CC(=NN=C3Cl)Cl

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)OCCN2CCN(CC2)C3=CC(=NN=C3Cl)Cl

InChI

InChI=1S/C20H24Cl2N4O3/c1-14(2)29-20(27)15-3-5-16(6-4-15)28-12-11-25-7-9-26(10-8-25)17-13-18(21)23-24-19(17)22/h3-6,13-14H,7-12H2,1-2H3