N,N-dimethyl-4-(3-nitrophenyl)carbonyl-piperazine-1-sulfonamide

Systemtic Name: N,N-dimethyl-4-(3-nitrophenyl)carbonyl-piperazine-1-sulfonamide Openeye Name: N,N-dimethyl-4-(3-nitrobenzoyl)piperazine-1-sulfonamide CAS Name: N,N-dimethyl-4-[(3-nitrophenyl)-oxomethyl]-1-piperazinesulfonamide IUPAC Name: N,N-dimethyl-4-(3-nitrobenzoyl)piperazine-1-sulfonamide Traditional Name: N,N-dimethyl-4-(3-nitrobenzoyl)piperazine-1-sulfonamide Formula: C13H18N4O5S MolecularWeight: 342.37082

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H18N4O5S/c1-14(2)23(21,22)16-8-6-15(7-9-16)13(18)11-4-3-5-12(10-11)17(19)20/h3-5,10H,6-9H2,1-2H3