methyl 2-(4-chlorophenyl)-2-[4-(3-thiophen-3-ylpropanoyl)piperazin-1-yl]ethanoate

Systemtic Name: methyl 2-(4-chlorophenyl)-2-[4-(3-thiophen-3-ylpropanoyl)piperazin-1-yl]ethanoate Openeye Name: methyl 2-(4-chlorophenyl)-2-[4-[3-(3-thienyl)propanoyl]piperazin-1-yl]acetate CAS Name: 2-(4-chlorophenyl)-2-[4-[1-oxo-3-(3-thiophenyl)propyl]-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-(4-chlorophenyl)-2-[4-(3-thiophen-3-ylpropanoyl)piperazin-1-yl]acetate Traditional Name: 2-(4-chlorophenyl)-2-[4-[3-(3-thienyl)propanoyl]piperazino]acetic acid methyl ester Formula: C20H23ClN2O3S MolecularWeight: 406.92622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=C(C=C1)Cl)N2CCN(CC2)C(=O)CCC3=CSC=C3

Isomeric SMILES

COC(=O)C(C1=CC=C(C=C1)Cl)N2CCN(CC2)C(=O)CCC3=CSC=C3

InChI

InChI=1S/C20H23ClN2O3S/c1-26-20(25)19(16-3-5-17(21)6-4-16)23-11-9-22(10-12-23)18(24)7-2-15-8-13-27-14-15/h3-6,8,13-14,19H,2,7,9-12H2,1H3