2-[4-[4-(2-chlorophenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-(4-ethoxyphenyl)pyridazin-3-one

Systemtic Name: 2-[4-[4-(2-chlorophenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-(4-ethoxyphenyl)pyridazin-3-one Openeye Name: 2-[4-[4-(2-chlorophenyl)piperazin-1-yl]-4-oxo-butyl]-6-(4-ethoxyphenyl)pyridazin-3-one CAS Name: 2-[4-[4-(2-chlorophenyl)-1-piperazinyl]-4-oxobutyl]-6-(4-ethoxyphenyl)-3-pyridazinone IUPAC Name: 2-[4-[4-(2-chlorophenyl)piperazin-1-yl]-4-oxobutyl]-6-(4-ethoxyphenyl)pyridazin-3-one Traditional Name: 2-[4-[4-(2-chlorophenyl)piperazino]-4-keto-butyl]-6-p-phenetyl-pyridazin-3-one Formula: C26H29ClN4O3 MolecularWeight: 480.98646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)N3CCN(CC3)C4=CC=CC=C4Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)N3CCN(CC3)C4=CC=CC=C4Cl

InChI

InChI=1S/C26H29ClN4O3/c1-2-34-21-11-9-20(10-12-21)23-13-14-26(33)31(28-23)15-5-8-25(32)30-18-16-29(17-19-30)24-7-4-3-6-22(24)27/h3-4,6-7,9-14H,2,5,8,15-19H2,1H3