ethyl 3-[2-(4-propan-2-ylsulfonylphenyl)ethanoylamino]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[2-(4-propan-2-ylsulfonylphenyl)ethanoylamino]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[2-(4-isopropylsulfonylphenyl)acetyl]amino]benzofuran-2-carboxylate CAS Name: 3-[[1-oxo-2-(4-propan-2-ylsulfonylphenyl)ethyl]amino]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-propan-2-ylsulfonylphenyl)acetyl]amino]-1-benzofuran-2-carboxylate Traditional Name: 3-[[2-(4-isopropylsulfonylphenyl)acetyl]amino]coumarilic acid ethyl ester Formula: C22H23NO6S MolecularWeight: 429.48612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)CC3=CC=C(C=C3)S(=O)(=O)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)CC3=CC=C(C=C3)S(=O)(=O)C(C)C

InChI

InChI=1S/C22H23NO6S/c1-4-28-22(25)21-20(17-7-5-6-8-18(17)29-21)23-19(24)13-15-9-11-16(12-10-15)30(26,27)14(2)3/h5-12,14H,4,13H2,1-3H3,(H,23,24)