1-(4-chloranyl-2-nitro-phenyl)-4-ethylsulfonyl-piperazine

Systemtic Name: 1-(4-chloranyl-2-nitro-phenyl)-4-ethylsulfonyl-piperazine Openeye Name: 1-(4-chloro-2-nitro-phenyl)-4-ethylsulfonyl-piperazine CAS Name: 1-(4-chloro-2-nitrophenyl)-4-ethylsulfonylpiperazine IUPAC Name: 1-(4-chloro-2-nitrophenyl)-4-ethylsulfonylpiperazine Traditional Name: 1-(4-chloro-2-nitro-phenyl)-4-esyl-piperazine Formula: C12H16ClN3O4S MolecularWeight: 333.79114

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

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