5-[(2-chlorophenyl)methoxy]-2-[(4-undec-10-enoylpiperazin-1-yl)methyl]pyran-4-one

Systemtic Name: 5-[(2-chlorophenyl)methoxy]-2-[(4-undec-10-enoylpiperazin-1-yl)methyl]pyran-4-one Openeye Name: 5-[(2-chlorophenyl)methoxy]-2-[(4-undec-10-enoylpiperazin-1-yl)methyl]pyran-4-one CAS Name: 5-[(2-chlorophenyl)methoxy]-2-[[4-(1-oxoundec-10-enyl)-1-piperazinyl]methyl]-4-pyranone IUPAC Name: 5-[(2-chlorophenyl)methoxy]-2-[(4-undec-10-enoylpiperazin-1-yl)methyl]pyran-4-one Traditional Name: 5-(2-chlorobenzyl)oxy-2-[(4-undec-10-enoylpiperazino)methyl]pyran-4-one Formula: C28H37ClN2O4 MolecularWeight: 501.05738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H37ClN2O4/c1-2-3-4-5-6-7-8-9-14-28(33)31-17-15-30(16-18-31)20-24-19-26(32)27(22-34-24)35-21-23-12-10-11-13-25(23)29/h2,10-13,19,22H,1,3-9,14-18,20-21H2