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

Systemtic Name: 1-(2-chloranyl-4-nitro-phenyl)-4-ethylsulfonyl-piperazine Openeye Name: 1-(2-chloro-4-nitro-phenyl)-4-ethylsulfonyl-piperazine CAS Name: 1-(2-chloro-4-nitrophenyl)-4-ethylsulfonylpiperazine IUPAC Name: 1-(2-chloro-4-nitrophenyl)-4-ethylsulfonylpiperazine Traditional Name: 1-(2-chloro-4-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)[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

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