(2S)-4-(2,4-dinitrophenyl)-2-methyl-1-methylsulfonyl-piperazine

Systemtic Name: (2S)-4-(2,4-dinitrophenyl)-2-methyl-1-methylsulfonyl-piperazine Openeye Name: (2S)-4-(2,4-dinitrophenyl)-2-methyl-1-methylsulfonyl-piperazine CAS Name: (2S)-4-(2,4-dinitrophenyl)-2-methyl-1-methylsulfonylpiperazine IUPAC Name: (2S)-4-(2,4-dinitrophenyl)-2-methyl-1-methylsulfonylpiperazine Traditional Name: (2S)-4-(2,4-dinitrophenyl)-1-mesyl-2-methyl-piperazine Formula: C12H16N4O6S MolecularWeight: 344.34364

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CN(CCN1S(=O)(=O)C)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O6S/c1-9-8-13(5-6-14(9)23(2,21)22)11-4-3-10(15(17)18)7-12(11)16(19)20/h3-4,7,9H,5-6,8H2,1-2H3/t9-/m0/s1