1-(4-chlorophenyl)-2-[4-[[3,5-di(nonoxy)-4-oxidanyl-phenyl]methyl]piperazin-1-yl]ethanone

Systemtic Name: 1-(4-chlorophenyl)-2-[4-[[3,5-di(nonoxy)-4-oxidanyl-phenyl]methyl]piperazin-1-yl]ethanone Openeye Name: 1-(4-chlorophenyl)-2-[4-[[4-hydroxy-3,5-di(nonoxy)phenyl]methyl]piperazin-1-yl]ethanone CAS Name: 1-(4-chlorophenyl)-2-[4-[[4-hydroxy-3,5-di(nonoxy)phenyl]methyl]-1-piperazinyl]ethanone IUPAC Name: 1-(4-chlorophenyl)-2-[4-[[4-hydroxy-3,5-di(nonoxy)phenyl]methyl]piperazin-1-yl]ethanone Traditional Name: 1-(4-chlorophenyl)-2-[4-[4-hydroxy-3,5-di(nonoxy)benzyl]piperazino]ethanone Formula: C37H57ClN2O4 MolecularWeight: 629.31248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC(=CC(=C1O)OCCCCCCCCC)CN2CCN(CC2)CC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCCCCCCOC1=CC(=CC(=C1O)OCCCCCCCCC)CN2CCN(CC2)CC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C37H57ClN2O4/c1-3-5-7-9-11-13-15-25-43-35-27-31(28-36(37(35)42)44-26-16-14-12-10-8-6-4-2)29-39-21-23-40(24-22-39)30-34(41)32-17-19-33(38)20-18-32/h17-20,27-28,42H,3-16,21-26,29-30H2,1-2H3