octyl 5-[(4-tert-butylphenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: octyl 5-[(4-tert-butylphenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: octyl 5-[(4-tert-butylphenyl)sulfonylamino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[(4-tert-butylphenyl)sulfonylamino]-2-methyl-3-benzofurancarboxylic acid octyl ester IUPAC Name: octyl 5-[(4-tert-butylphenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-tert-butylphenyl)sulfonylamino]-2-methyl-benzofuran-3-carboxylic acid octyl ester Formula: C28H37NO5S MolecularWeight: 499.66208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H37NO5S/c1-6-7-8-9-10-11-18-33-27(30)26-20(2)34-25-17-14-22(19-24(25)26)29-35(31,32)23-15-12-21(13-16-23)28(3,4)5/h12-17,19,29H,6-11,18H2,1-5H3