1-(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-4-(4-nitrophenyl)piperazine

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

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