ethyl 3-[[2-(4-chlorophenyl)phenyl]methyl]-2-piperazin-1-yl-benzenecarboperoxoate

Systemtic Name: ethyl 3-[[2-(4-chlorophenyl)phenyl]methyl]-2-piperazin-1-yl-benzenecarboperoxoate Openeye Name: ethyl 3-[[2-(4-chlorophenyl)phenyl]methyl]-2-piperazin-1-yl-benzenecarboperoxoate CAS Name: 3-[[2-(4-chlorophenyl)phenyl]methyl]-2-(1-piperazinyl)benzenecarboperoxoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-chlorophenyl)phenyl]methyl]-2-piperazin-1-ylbenzenecarboperoxoate Traditional Name: 3-[2-(4-chlorophenyl)benzyl]-2-piperazino-benzenecarboperoxoic acid ethyl ester Formula: C26H27ClN2O3 MolecularWeight: 450.95718

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Descriptors Computed from Structure

Canonical SMILES:

CCOOC(=O)C1=C(C(=CC=C1)CC2=CC=CC=C2C3=CC=C(C=C3)Cl)N4CCNCC4

Isomeric SMILES

CCOOC(=O)C1=C(C(=CC=C1)CC2=CC=CC=C2C3=CC=C(C=C3)Cl)N4CCNCC4

InChI

InChI=1S/C26H27ClN2O3/c1-2-31-32-26(30)24-9-5-7-21(25(24)29-16-14-28-15-17-29)18-20-6-3-4-8-23(20)19-10-12-22(27)13-11-19/h3-13,28H,2,14-18H2,1H3