[1-(6-chloranyl-4,5-dimethyl-pyridazin-3-yl)piperidin-4-yl] 2-ethoxybenzoate

Systemtic Name: [1-(6-chloranyl-4,5-dimethyl-pyridazin-3-yl)piperidin-4-yl] 2-ethoxybenzoate Openeye Name: [1-(6-chloro-4,5-dimethyl-pyridazin-3-yl)-4-piperidyl] 2-ethoxybenzoate CAS Name: 2-ethoxybenzoic acid [1-(6-chloro-4,5-dimethyl-3-pyridazinyl)-4-piperidinyl] ester IUPAC Name: [1-(6-chloro-4,5-dimethylpyridazin-3-yl)piperidin-4-yl] 2-ethoxybenzoate Traditional Name: 2-ethoxybenzoic acid [1-(6-chloro-4,5-dimethyl-pyridazin-3-yl)-4-piperidyl] ester Formula: C20H24ClN3O3 MolecularWeight: 389.87586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)OC2CCN(CC2)C3=NN=C(C(=C3C)C)Cl

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)OC2CCN(CC2)C3=NN=C(C(=C3C)C)Cl

InChI

InChI=1S/C20H24ClN3O3/c1-4-26-17-8-6-5-7-16(17)20(25)27-15-9-11-24(12-10-15)19-14(3)13(2)18(21)22-23-19/h5-8,15H,4,9-12H2,1-3H3