1-(2-chloranyl-4-nitro-phenyl)-4-(2,5-dimethylphenyl)sulfonyl-piperazine

Systemtic Name: 1-(2-chloranyl-4-nitro-phenyl)-4-(2,5-dimethylphenyl)sulfonyl-piperazine Openeye Name: 1-(2-chloro-4-nitro-phenyl)-4-(2,5-dimethylphenyl)sulfonyl-piperazine CAS Name: 1-(2-chloro-4-nitrophenyl)-4-(2,5-dimethylphenyl)sulfonylpiperazine IUPAC Name: 1-(2-chloro-4-nitrophenyl)-4-(2,5-dimethylphenyl)sulfonylpiperazine Traditional Name: 1-(2-chloro-4-nitro-phenyl)-4-(2,5-dimethylphenyl)sulfonyl-piperazine Formula: C18H20ClN3O4S MolecularWeight: 409.8871

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H20ClN3O4S/c1-13-3-4-14(2)18(11-13)27(25,26)21-9-7-20(8-10-21)17-6-5-15(22(23)24)12-16(17)19/h3-6,11-12H,7-10H2,1-2H3