ethyl 2-methyl-5-[[methylsulfonyl(pentyl)carbamoyl]carbamoyloxy]-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-[[methylsulfonyl(pentyl)carbamoyl]carbamoyloxy]-1-benzofuran-3-carboxylate Openeye Name: ethyl 2-methyl-5-[[methylsulfonyl(pentyl)carbamoyl]carbamoyloxy]benzofuran-3-carboxylate CAS Name: 2-methyl-5-[[[[methylsulfonyl(pentyl)amino]-oxomethyl]amino]-oxomethoxy]-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-5-[[methylsulfonyl(pentyl)carbamoyl]carbamoyloxy]-1-benzofuran-3-carboxylate Traditional Name: 5-[[amyl(mesyl)carbamoyl]carbamoyloxy]-2-methyl-benzofuran-3-carboxylic acid ethyl ester Formula: C20H26N2O8S MolecularWeight: 454.49404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C(=O)NC(=O)OC1=CC2=C(C=C1)OC(=C2C(=O)OCC)C)S(=O)(=O)C

Isomeric SMILES

CCCCCN(C(=O)NC(=O)OC1=CC2=C(C=C1)OC(=C2C(=O)OCC)C)S(=O)(=O)C

InChI

InChI=1S/C20H26N2O8S/c1-5-7-8-11-22(31(4,26)27)19(24)21-20(25)30-14-9-10-16-15(12-14)17(13(3)29-16)18(23)28-6-2/h9-10,12H,5-8,11H2,1-4H3,(H,21,24,25)