O4-tert-butyl O1-[[3-[2-(3-chlorophenyl)ethoxy]phenyl]methyl] piperazine-1,4-dicarboxylate

Systemtic Name: O4-tert-butyl O1-[[3-[2-(3-chlorophenyl)ethoxy]phenyl]methyl] piperazine-1,4-dicarboxylate Openeye Name: O4-tert-butyl O1-[[3-[2-(3-chlorophenyl)ethoxy]phenyl]methyl] piperazine-1,4-dicarboxylate CAS Name: piperazine-1,4-dicarboxylic acid O4-tert-butyl ester O1-[[3-[2-(3-chlorophenyl)ethoxy]phenyl]methyl] ester IUPAC Name: 4-O-tert-butyl 1-O-[[3-[2-(3-chlorophenyl)ethoxy]phenyl]methyl] piperazine-1,4-dicarboxylate Traditional Name: piperazine-1,4-dicarboxylic acid O4-tert-butyl ester O1-[3-[2-(3-chlorophenyl)ethoxy]benzyl] ester Formula: C25H31ClN2O5 MolecularWeight: 474.97704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)OCC2=CC(=CC=C2)OCCC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)OCC2=CC(=CC=C2)OCCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C25H31ClN2O5/c1-25(2,3)33-24(30)28-13-11-27(12-14-28)23(29)32-18-20-7-5-9-22(17-20)31-15-10-19-6-4-8-21(26)16-19/h4-9,16-17H,10-15,18H2,1-3H3