1-(2-methyl-1H-indol-3-yl)-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]ethanone

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

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