4-(2-bromanylphenoxy)-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(2-bromanylphenoxy)-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-(2-bromophenoxy)-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-(2-bromophenoxy)-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(2-bromophenoxy)-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-(2-bromophenoxy)-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C16H17BrN2O5S MolecularWeight: 429.28558

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC2=CC=CC=C2Br)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC2=CC=CC=C2Br)[N+](=O)[O-]

InChI

InChI=1S/C16H17BrN2O5S/c1-3-18(4-2)25(22,23)12-9-10-16(14(11-12)19(20)21)24-15-8-6-5-7-13(15)17/h5-11H,3-4H2,1-2H3