ethyl 3-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzofuran-2-carboxylate CAS Name: 3-[[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]-1-benzofuran-2-carboxylate Traditional Name: 3-[(4-pyrrolidinosulfonylbenzoyl)amino]coumarilic acid ethyl ester Formula: C22H22N2O6S MolecularWeight: 442.48488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H22N2O6S/c1-2-29-22(26)20-19(17-7-3-4-8-18(17)30-20)23-21(25)15-9-11-16(12-10-15)31(27,28)24-13-5-6-14-24/h3-4,7-12H,2,5-6,13-14H2,1H3,(H,23,25)