2-bromanyl-N-(cyanomethyl)-4,5-dimethoxy-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 2-bromanyl-N-(cyanomethyl)-4,5-dimethoxy-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-2-bromo-N-(cyanomethyl)-4,5-dimethoxy-benzenesulfonamide CAS Name: 2-bromo-N-(cyanomethyl)-4,5-dimethoxy-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-2-bromo-N-(cyanomethyl)-4,5-dimethoxybenzenesulfonamide Traditional Name: N-benzyl-2-bromo-N-(cyanomethyl)-4,5-dimethoxy-benzenesulfonamide Formula: C17H17BrN2O4S MolecularWeight: 425.29688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1OC)Br)S(=O)(=O)N(CC#N)CC2=CC=CC=C2

Isomeric SMILES

COC1=CC(=C(C=C1OC)Br)S(=O)(=O)N(CC#N)CC2=CC=CC=C2

InChI

InChI=1S/C17H17BrN2O4S/c1-23-15-10-14(18)17(11-16(15)24-2)25(21,22)20(9-8-19)12-13-6-4-3-5-7-13/h3-7,10-11H,9,12H2,1-2H3