[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl] 2-(3-chloranylphenoxy)propanoate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl] 2-(3-chloranylphenoxy)propanoate Openeye Name: [2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxo-ethyl] 2-(3-chlorophenoxy)propanoate CAS Name: 2-(3-chlorophenoxy)propanoic acid [2-[4-(benzenesulfonyl)-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethyl] 2-(3-chlorophenoxy)propanoate Traditional Name: 2-(3-chlorophenoxy)propionic acid [2-(4-besylpiperazino)-2-keto-ethyl] ester Formula: C21H23ClN2O6S MolecularWeight: 466.93512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2)OC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C(=O)OCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H23ClN2O6S/c1-16(30-18-7-5-6-17(22)14-18)21(26)29-15-20(25)23-10-12-24(13-11-23)31(27,28)19-8-3-2-4-9-19/h2-9,14,16H,10-13,15H2,1H3