1-(1H-indol-3-yl)-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 1-(1H-indol-3-yl)-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 1-(1H-indol-3-yl)-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 1-(1H-indol-3-yl)-2-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 1-(1H-indol-3-yl)-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 1-(1H-indol-3-yl)-2-[4-(2-nitrophenyl)sulfonylpiperazino]propan-1-one Formula: C21H22N4O5S MolecularWeight: 442.48818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)C1=CNC2=CC=CC=C21)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O5S/c1-15(21(26)17-14-22-18-7-3-2-6-16(17)18)23-10-12-24(13-11-23)31(29,30)20-9-5-4-8-19(20)25(27)28/h2-9,14-15,22H,10-13H2,1H3