pentyl 2,6-dimethyl-5-(quinolin-8-ylsulfonylamino)-1-benzofuran-3-carboxylate

Systemtic Name: pentyl 2,6-dimethyl-5-(quinolin-8-ylsulfonylamino)-1-benzofuran-3-carboxylate Openeye Name: pentyl 2,6-dimethyl-5-(8-quinolylsulfonylamino)benzofuran-3-carboxylate CAS Name: 2,6-dimethyl-5-(8-quinolinylsulfonylamino)-3-benzofurancarboxylic acid pentyl ester IUPAC Name: pentyl 2,6-dimethyl-5-(quinolin-8-ylsulfonylamino)-1-benzofuran-3-carboxylate Traditional Name: 2,6-dimethyl-5-(8-quinolylsulfonylamino)benzofuran-3-carboxylic acid amyl ester Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(OC2=CC(=C(C=C21)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4)C)C

Isomeric SMILES

CCCCCOC(=O)C1=C(OC2=CC(=C(C=C21)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4)C)C

InChI

InChI=1S/C25H26N2O5S/c1-4-5-6-13-31-25(28)23-17(3)32-21-14-16(2)20(15-19(21)23)27-33(29,30)22-11-7-9-18-10-8-12-26-24(18)22/h7-12,14-15,27H,4-6,13H2,1-3H3