2-(2-methylindol-1-yl)-1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]ethanone

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2N1CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=CC=CC=C2N1CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

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