methyl 4-[4-(6-chloranylpyridazin-3-yl)piperazin-1-yl]-2-ethyl-benzoate

Systemtic Name: methyl 4-[4-(6-chloranylpyridazin-3-yl)piperazin-1-yl]-2-ethyl-benzoate Openeye Name: methyl 4-[4-(6-chloropyridazin-3-yl)piperazin-1-yl]-2-ethyl-benzoate CAS Name: 4-[4-(6-chloro-3-pyridazinyl)-1-piperazinyl]-2-ethylbenzoic acid methyl ester IUPAC Name: methyl 4-[4-(6-chloropyridazin-3-yl)piperazin-1-yl]-2-ethylbenzoate Traditional Name: 4-[4-(6-chloropyridazin-3-yl)piperazino]-2-ethyl-benzoic acid methyl ester Formula: C18H21ClN4O2 MolecularWeight: 360.83794

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)N2CCN(CC2)C3=NN=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

CCC1=C(C=CC(=C1)N2CCN(CC2)C3=NN=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C18H21ClN4O2/c1-3-13-12-14(4-5-15(13)18(24)25-2)22-8-10-23(11-9-22)17-7-6-16(19)20-21-17/h4-7,12H,3,8-11H2,1-2H3