3-[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethoxy]benzaldehyde

Systemtic Name: 3-[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethoxy]benzaldehyde Openeye Name: 3-[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxo-ethoxy]benzaldehyde CAS Name: 3-[2-[4-(benzenesulfonyl)-1-piperazinyl]-2-oxoethoxy]benzaldehyde IUPAC Name: 3-[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethoxy]benzaldehyde Traditional Name: 3-[2-(4-besylpiperazino)-2-keto-ethoxy]benzaldehyde Formula: C19H20N2O5S MolecularWeight: 388.4375

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=CC=CC(=C2)C=O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)COC2=CC=CC(=C2)C=O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H20N2O5S/c22-14-16-5-4-6-17(13-16)26-15-19(23)20-9-11-21(12-10-20)27(24,25)18-7-2-1-3-8-18/h1-8,13-14H,9-12,15H2