ethyl 7-bromanyl-2-methyl-5-(naphthalen-2-ylsulfonylamino)-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 7-bromanyl-2-methyl-5-(naphthalen-2-ylsulfonylamino)-1-benzofuran-3-carboxylate Openeye Name: ethyl 7-bromo-2-methyl-5-(2-naphthylsulfonylamino)benzofuran-3-carboxylate CAS Name: 7-bromo-2-methyl-5-(2-naphthalenylsulfonylamino)-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 7-bromo-2-methyl-5-(naphthalen-2-ylsulfonylamino)-1-benzofuran-3-carboxylate Traditional Name: 7-bromo-2-methyl-5-(2-naphthylsulfonylamino)benzofuran-3-carboxylic acid ethyl ester Formula: C22H18BrNO5S MolecularWeight: 488.35102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C=C(C=C12)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)Br)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C(C=C(C=C12)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)Br)C

InChI

InChI=1S/C22H18BrNO5S/c1-3-28-22(25)20-13(2)29-21-18(20)11-16(12-19(21)23)24-30(26,27)17-9-8-14-6-4-5-7-15(14)10-17/h4-12,24H,3H2,1-2H3