pentyl 2-[1-(4-chlorophenyl)sulfonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: pentyl 2-[1-(4-chlorophenyl)sulfonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: pentyl 2-[1-(4-chlorophenyl)sulfonyl-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-(4-chlorophenyl)sulfonyl-3-oxo-2-piperazinyl]acetic acid pentyl ester IUPAC Name: pentyl 2-[1-(4-chlorophenyl)sulfonyl-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(4-chlorophenyl)sulfonyl-3-keto-piperazin-2-yl]acetic acid amyl ester Formula: C17H23ClN2O5S MolecularWeight: 402.89292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CC1C(=O)NCCN1S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCOC(=O)CC1C(=O)NCCN1S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H23ClN2O5S/c1-2-3-4-11-25-16(21)12-15-17(22)19-9-10-20(15)26(23,24)14-7-5-13(18)6-8-14/h5-8,15H,2-4,9-12H2,1H3,(H,19,22)