4-bromanyl-N-methyl-N-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-methyl-N-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: 4-bromo-N-methyl-N-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxo-ethyl]benzenesulfonamide CAS Name: 4-bromo-N-methyl-N-[2-[4-(2-nitrophenyl)-1-piperazinyl]-2-oxoethyl]benzenesulfonamide IUPAC Name: 4-bromo-N-methyl-N-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxoethyl]benzenesulfonamide Traditional Name: 4-bromo-N-[2-keto-2-[4-(2-nitrophenyl)piperazino]ethyl]-N-methyl-benzenesulfonamide Formula: C19H21BrN4O5S MolecularWeight: 497.36284

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCN(CC1)C2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CN(CC(=O)N1CCN(CC1)C2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H21BrN4O5S/c1-21(30(28,29)16-8-6-15(20)7-9-16)14-19(25)23-12-10-22(11-13-23)17-4-2-3-5-18(17)24(26)27/h2-9H,10-14H2,1H3