(2S)-4-(4-chloranyl-2-nitro-phenyl)-2-methyl-1-methylsulfonyl-piperazine

Systemtic Name: (2S)-4-(4-chloranyl-2-nitro-phenyl)-2-methyl-1-methylsulfonyl-piperazine Openeye Name: (2S)-4-(4-chloro-2-nitro-phenyl)-2-methyl-1-methylsulfonyl-piperazine CAS Name: (2S)-4-(4-chloro-2-nitrophenyl)-2-methyl-1-methylsulfonylpiperazine IUPAC Name: (2S)-4-(4-chloro-2-nitrophenyl)-2-methyl-1-methylsulfonylpiperazine Traditional Name: (2S)-4-(4-chloro-2-nitro-phenyl)-1-mesyl-2-methyl-piperazine Formula: C12H16ClN3O4S MolecularWeight: 333.79114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16ClN3O4S/c1-9-8-14(5-6-15(9)21(2,19)20)11-4-3-10(13)7-12(11)16(17)18/h3-4,7,9H,5-6,8H2,1-2H3/t9-/m0/s1