ethyl 3-[[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]oxymethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]oxymethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[(2S)-3-methyl-2-(p-tolylsulfonylamino)butanoyl]oxymethyl]benzofuran-2-carboxylate CAS Name: 3-[[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-1-oxobutoxy]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]oxymethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[(2S)-3-methyl-2-(tosylamino)butanoyl]oxymethyl]coumarilic acid ethyl ester Formula: C24H27NO7S MolecularWeight: 473.53868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)C(C(C)C)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)[C@H](C(C)C)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H27NO7S/c1-5-30-24(27)22-19(18-8-6-7-9-20(18)32-22)14-31-23(26)21(15(2)3)25-33(28,29)17-12-10-16(4)11-13-17/h6-13,15,21,25H,5,14H2,1-4H3/t21-/m0/s1