5-[(2-chlorophenyl)methoxy]-2-[(4-hexanoylpiperazin-1-yl)methyl]pyran-4-one

Systemtic Name: 5-[(2-chlorophenyl)methoxy]-2-[(4-hexanoylpiperazin-1-yl)methyl]pyran-4-one Openeye Name: 5-[(2-chlorophenyl)methoxy]-2-[(4-hexanoylpiperazin-1-yl)methyl]pyran-4-one CAS Name: 5-[(2-chlorophenyl)methoxy]-2-[[4-(1-oxohexyl)-1-piperazinyl]methyl]-4-pyranone IUPAC Name: 5-[(2-chlorophenyl)methoxy]-2-[(4-hexanoylpiperazin-1-yl)methyl]pyran-4-one Traditional Name: 2-[(4-caproylpiperazino)methyl]-5-(2-chlorobenzyl)oxy-pyran-4-one Formula: C23H29ClN2O4 MolecularWeight: 432.94036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1CCN(CC1)CC2=CC(=O)C(=CO2)OCC3=CC=CC=C3Cl

Isomeric SMILES

CCCCCC(=O)N1CCN(CC1)CC2=CC(=O)C(=CO2)OCC3=CC=CC=C3Cl

InChI

InChI=1S/C23H29ClN2O4/c1-2-3-4-9-23(28)26-12-10-25(11-13-26)15-19-14-21(27)22(17-29-19)30-16-18-7-5-6-8-20(18)24/h5-8,14,17H,2-4,9-13,15-16H2,1H3