octyl 2-methyl-5-[(2,4,5-trimethylphenyl)sulfonylamino]-1-benzofuran-3-carboxylate

Systemtic Name: octyl 2-methyl-5-[(2,4,5-trimethylphenyl)sulfonylamino]-1-benzofuran-3-carboxylate Openeye Name: octyl 2-methyl-5-[(2,4,5-trimethylphenyl)sulfonylamino]benzofuran-3-carboxylate CAS Name: 2-methyl-5-[(2,4,5-trimethylphenyl)sulfonylamino]-3-benzofurancarboxylic acid octyl ester IUPAC Name: octyl 2-methyl-5-[(2,4,5-trimethylphenyl)sulfonylamino]-1-benzofuran-3-carboxylate Traditional Name: 2-methyl-5-[(2,4,5-trimethylphenyl)sulfonylamino]benzofuran-3-carboxylic acid octyl ester Formula: C27H35NO5S MolecularWeight: 485.6355

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=C(OC2=C1C=C(C=C2)NS(=O)(=O)C3=C(C=C(C(=C3)C)C)C)C

Isomeric SMILES

CCCCCCCCOC(=O)C1=C(OC2=C1C=C(C=C2)NS(=O)(=O)C3=C(C=C(C(=C3)C)C)C)C

InChI

InChI=1S/C27H35NO5S/c1-6-7-8-9-10-11-14-32-27(29)26-21(5)33-24-13-12-22(17-23(24)26)28-34(30,31)25-16-19(3)18(2)15-20(25)4/h12-13,15-17,28H,6-11,14H2,1-5H3