heptyl 2-methyl-5-(phenylsulfonylamino)-1-benzofuran-3-carboxylate

Systemtic Name: heptyl 2-methyl-5-(phenylsulfonylamino)-1-benzofuran-3-carboxylate Openeye Name: heptyl 5-(benzenesulfonamido)-2-methyl-benzofuran-3-carboxylate CAS Name: 5-(benzenesulfonamido)-2-methyl-3-benzofurancarboxylic acid heptyl ester IUPAC Name: heptyl 5-(benzenesulfonamido)-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-(benzenesulfonamido)-2-methyl-benzofuran-3-carboxylic acid heptyl ester Formula: C23H27NO5S MolecularWeight: 429.52918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=C(OC2=C1C=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCCCCCCOC(=O)C1=C(OC2=C1C=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C23H27NO5S/c1-3-4-5-6-10-15-28-23(25)22-17(2)29-21-14-13-18(16-20(21)22)24-30(26,27)19-11-8-7-9-12-19/h7-9,11-14,16,24H,3-6,10,15H2,1-2H3