2-(4-chloranyl-3-methyl-phenoxy)-1-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]propan-1-one

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-1-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]propan-1-one Openeye Name: 2-(4-chloro-3-methyl-phenoxy)-1-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]propan-1-one CAS Name: 2-(4-chloro-3-methylphenoxy)-1-[4-[6-(4-ethoxyphenyl)-3-pyridazinyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-(4-chloro-3-methylphenoxy)-1-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]propan-1-one Traditional Name: 2-(4-chloro-3-methyl-phenoxy)-1-[4-(6-p-phenetylpyridazin-3-yl)piperazino]propan-1-one Formula: C26H29ClN4O3 MolecularWeight: 480.98646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C(C)OC4=CC(=C(C=C4)Cl)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C(C)OC4=CC(=C(C=C4)Cl)C

InChI

InChI=1S/C26H29ClN4O3/c1-4-33-21-7-5-20(6-8-21)24-11-12-25(29-28-24)30-13-15-31(16-14-30)26(32)19(3)34-22-9-10-23(27)18(2)17-22/h5-12,17,19H,4,13-16H2,1-3H3