4-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonyl-N,N-diethyl-piperazine-1-sulfonamide

Systemtic Name: 4-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonyl-N,N-diethyl-piperazine-1-sulfonamide Openeye Name: 4-(3-chloro-4-methyl-5-nitro-phenyl)sulfonyl-N,N-diethyl-piperazine-1-sulfonamide CAS Name: 4-(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-N,N-diethyl-1-piperazinesulfonamide IUPAC Name: 4-(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-N,N-diethylpiperazine-1-sulfonamide Traditional Name: 4-(3-chloro-4-methyl-5-nitro-phenyl)sulfonyl-N,N-diethyl-piperazine-1-sulfonamide Formula: C15H23ClN4O6S2 MolecularWeight: 454.94932

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)Cl

InChI

InChI=1S/C15H23ClN4O6S2/c1-4-17(5-2)28(25,26)19-8-6-18(7-9-19)27(23,24)13-10-14(16)12(3)15(11-13)20(21)22/h10-11H,4-9H2,1-3H3