methyl 2-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]-5-ethanoyl-benzoate

Systemtic Name: methyl 2-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]-5-ethanoyl-benzoate Openeye Name: methyl 5-acetyl-2-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxo-ethoxy]benzoate CAS Name: 5-acetyl-2-[2-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 5-acetyl-2-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxoethoxy]benzoate Traditional Name: 5-acetyl-2-[2-[4-(4-chlorobenzyl)piperazino]-2-keto-ethoxy]benzoic acid methyl ester Formula: C23H25ClN2O5 MolecularWeight: 444.908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C23H25ClN2O5/c1-16(27)18-5-8-21(20(13-18)23(29)30-2)31-15-22(28)26-11-9-25(10-12-26)14-17-3-6-19(24)7-4-17/h3-8,13H,9-12,14-15H2,1-2H3