5-(2-methoxyphenyl)-3-(phenylsulfonyl)-1-piperazin-1-yl-pentan-1-one

Systemtic Name: 5-(2-methoxyphenyl)-3-(phenylsulfonyl)-1-piperazin-1-yl-pentan-1-one Openeye Name: 3-(benzenesulfonyl)-5-(2-methoxyphenyl)-1-piperazin-1-yl-pentan-1-one CAS Name: 3-(benzenesulfonyl)-5-(2-methoxyphenyl)-1-(1-piperazinyl)-1-pentanone IUPAC Name: 3-(benzenesulfonyl)-5-(2-methoxyphenyl)-1-piperazin-1-ylpentan-1-one Traditional Name: 3-besyl-5-(2-methoxyphenyl)-1-piperazino-pentan-1-one Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCC(CC(=O)N2CCNCC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1CCC(CC(=O)N2CCNCC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H28N2O4S/c1-28-21-10-6-5-7-18(21)11-12-20(17-22(25)24-15-13-23-14-16-24)29(26,27)19-8-3-2-4-9-19/h2-10,20,23H,11-17H2,1H3