3-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]carbonyl-N-ethyl-4-methyl-benzenesulfonamide

Systemtic Name: 3-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]carbonyl-N-ethyl-4-methyl-benzenesulfonamide Openeye Name: 3-[4-(4-chloro-2-nitro-phenyl)piperazine-1-carbonyl]-N-ethyl-4-methyl-benzenesulfonamide CAS Name: 3-[[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-oxomethyl]-N-ethyl-4-methylbenzenesulfonamide IUPAC Name: 3-[4-(4-chloro-2-nitrophenyl)piperazine-1-carbonyl]-N-ethyl-4-methylbenzenesulfonamide Traditional Name: 3-[4-(4-chloro-2-nitro-phenyl)piperazine-1-carbonyl]-N-ethyl-4-methyl-benzenesulfonamide Formula: C20H23ClN4O5S MolecularWeight: 466.93842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClN4O5S/c1-3-22-31(29,30)16-6-4-14(2)17(13-16)20(26)24-10-8-23(9-11-24)18-7-5-15(21)12-19(18)25(27)28/h4-7,12-13,22H,3,8-11H2,1-2H3