4-methylsulfonyl-N-(3-nitrophenyl)piperazine-1-carboxamide

Systemtic Name: 4-methylsulfonyl-N-(3-nitrophenyl)piperazine-1-carboxamide Openeye Name: 4-methylsulfonyl-N-(3-nitrophenyl)piperazine-1-carboxamide CAS Name: 4-methylsulfonyl-N-(3-nitrophenyl)-1-piperazinecarboxamide IUPAC Name: 4-methylsulfonyl-N-(3-nitrophenyl)piperazine-1-carboxamide Traditional Name: 4-mesyl-N-(3-nitrophenyl)piperazine-1-carboxamide Formula: C12H16N4O5S MolecularWeight: 328.34424

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O5S/c1-22(20,21)15-7-5-14(6-8-15)12(17)13-10-3-2-4-11(9-10)16(18)19/h2-4,9H,5-8H2,1H3,(H,13,17)