phenyl 2-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-yl]ethanesulfonate

Systemtic Name: phenyl 2-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-yl]ethanesulfonate Openeye Name: phenyl 2-[4-(2-morpholino-2-oxo-ethyl)piperazin-1-yl]ethanesulfonate CAS Name: 2-[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazinyl]ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]ethanesulfonate Traditional Name: 2-[4-(2-keto-2-morpholino-ethyl)piperazino]ethanesulfonic acid phenyl ester Formula: C18H27N3O5S MolecularWeight: 397.48908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCS(=O)(=O)OC2=CC=CC=C2)CC(=O)N3CCOCC3

Isomeric SMILES

C1CN(CCN1CCS(=O)(=O)OC2=CC=CC=C2)CC(=O)N3CCOCC3

InChI

InChI=1S/C18H27N3O5S/c22-18(21-10-13-25-14-11-21)16-20-8-6-19(7-9-20)12-15-27(23,24)26-17-4-2-1-3-5-17/h1-5H,6-16H2