N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-(methylsulfonylmethyl)benzamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-(methylsulfonylmethyl)benzamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-3-(methylsulfonylmethyl)benzamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-(methylsulfonylmethyl)benzamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-(methylsulfonylmethyl)benzamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-3-(mesylmethyl)benzamide Formula: C19H22BrNO5S MolecularWeight: 456.35068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC(=CC=C2)CS(=O)(=O)C)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC(=CC=C2)CS(=O)(=O)C)Br)OC

InChI

InChI=1S/C19H22BrNO5S/c1-25-17-10-14(16(20)11-18(17)26-2)7-8-21-19(22)15-6-4-5-13(9-15)12-27(3,23)24/h4-6,9-11H,7-8,12H2,1-3H3,(H,21,22)