2-[(3-nitrophenyl)amino]-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(3-nitrophenyl)amino]-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(3-nitroanilino)ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-(3-nitroanilino)ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(3-nitroanilino)ethanone Traditional Name: 1-(4-besylpiperazino)-2-(3-nitroanilino)ethanone Formula: C18H20N4O5S MolecularWeight: 404.4402

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CNC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CNC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H20N4O5S/c23-18(14-19-15-5-4-6-16(13-15)22(24)25)20-9-11-21(12-10-20)28(26,27)17-7-2-1-3-8-17/h1-8,13,19H,9-12,14H2