N-(3-bromanylpropyl)-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-(3-bromanylpropyl)-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-(3-bromopropyl)-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-(3-bromopropyl)-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-(3-bromopropyl)-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-(3-bromopropyl)-4-methyl-3-nitro-benzenesulfonamide Formula: C10H13BrN2O4S MolecularWeight: 337.19022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCCBr)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCCBr)[N+](=O)[O-]

InChI

InChI=1S/C10H13BrN2O4S/c1-8-3-4-9(7-10(8)13(14)15)18(16,17)12-6-2-5-11/h3-4,7,12H,2,5-6H2,1H3