pentyl 5-[(2,5-dimethylphenyl)sulfonylamino]-2-methyl-benzo[g][1]benzofuran-3-carboxylate

Systemtic Name: pentyl 5-[(2,5-dimethylphenyl)sulfonylamino]-2-methyl-benzo[g][1]benzofuran-3-carboxylate Openeye Name: pentyl 5-[(2,5-dimethylphenyl)sulfonylamino]-2-methyl-benzo[g]benzofuran-3-carboxylate CAS Name: 5-[(2,5-dimethylphenyl)sulfonylamino]-2-methyl-3-benzo[g]benzofurancarboxylic acid pentyl ester IUPAC Name: pentyl 5-[(2,5-dimethylphenyl)sulfonylamino]-2-methylbenzo[g][1]benzofuran-3-carboxylate Traditional Name: 5-[(2,5-dimethylphenyl)sulfonylamino]-2-methyl-benzo[g]benzofuran-3-carboxylic acid amyl ester Formula: C27H29NO5S MolecularWeight: 479.58786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(OC2=C1C=C(C3=CC=CC=C32)NS(=O)(=O)C4=C(C=CC(=C4)C)C)C

Isomeric SMILES

CCCCCOC(=O)C1=C(OC2=C1C=C(C3=CC=CC=C32)NS(=O)(=O)C4=C(C=CC(=C4)C)C)C

InChI

InChI=1S/C27H29NO5S/c1-5-6-9-14-32-27(29)25-19(4)33-26-21-11-8-7-10-20(21)23(16-22(25)26)28-34(30,31)24-15-17(2)12-13-18(24)3/h7-8,10-13,15-16,28H,5-6,9,14H2,1-4H3