4-(3-cyclohexylpropoxy)-5-[4-(3,3-dimethylbutyl)piperazin-1-yl]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-(3-cyclohexylpropoxy)-5-[4-(3,3-dimethylbutyl)piperazin-1-yl]-2-phenyl-pyridazin-3-one Openeye Name: 4-(3-cyclohexylpropoxy)-5-[4-(3,3-dimethylbutyl)piperazin-1-yl]-2-phenyl-pyridazin-3-one CAS Name: 4-(3-cyclohexylpropoxy)-5-[4-(3,3-dimethylbutyl)-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-(3-cyclohexylpropoxy)-5-[4-(3,3-dimethylbutyl)piperazin-1-yl]-2-phenylpyridazin-3-one Traditional Name: 4-(3-cyclohexylpropoxy)-5-[4-(3,3-dimethylbutyl)piperazino]-2-phenyl-pyridazin-3-one Formula: C29H44N4O2 MolecularWeight: 480.68526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCN1CCN(CC1)C2=C(C(=O)N(N=C2)C3=CC=CC=C3)OCCCC4CCCCC4

Isomeric SMILES

CC(C)(C)CCN1CCN(CC1)C2=C(C(=O)N(N=C2)C3=CC=CC=C3)OCCCC4CCCCC4

InChI

InChI=1S/C29H44N4O2/c1-29(2,3)16-17-31-18-20-32(21-19-31)26-23-30-33(25-14-8-5-9-15-25)28(34)27(26)35-22-10-13-24-11-6-4-7-12-24/h5,8-9,14-15,23-24H,4,6-7,10-13,16-22H2,1-3H3