[4-(4-nitrophenyl)piperazin-1-yl]-[5-(phenylsulfonylmethyl)furan-2-yl]methanone

Systemtic Name: [4-(4-nitrophenyl)piperazin-1-yl]-[5-(phenylsulfonylmethyl)furan-2-yl]methanone Openeye Name: [5-(benzenesulfonylmethyl)-2-furyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [5-(benzenesulfonylmethyl)-2-furanyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [5-(benzenesulfonylmethyl)furan-2-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [5-(besylmethyl)-2-furyl]-[4-(4-nitrophenyl)piperazino]methanone Formula: C22H21N3O6S MolecularWeight: 455.48364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(O3)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(O3)CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O6S/c26-22(21-11-10-19(31-21)16-32(29,30)20-4-2-1-3-5-20)24-14-12-23(13-15-24)17-6-8-18(9-7-17)25(27)28/h1-11H,12-16H2