octyl 5-[(4-chloranyl-3-methyl-phenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: octyl 5-[(4-chloranyl-3-methyl-phenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: octyl 5-[(4-chloro-3-methyl-phenyl)sulfonylamino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[(4-chloro-3-methylphenyl)sulfonylamino]-2-methyl-3-benzofurancarboxylic acid octyl ester IUPAC Name: octyl 5-[(4-chloro-3-methylphenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-chloro-3-methyl-phenyl)sulfonylamino]-2-methyl-benzofuran-3-carboxylic acid octyl ester Formula: C25H30ClNO5S MolecularWeight: 492.0274

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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)Cl)C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H30ClNO5S/c1-4-5-6-7-8-9-14-31-25(28)24-18(3)32-23-13-10-19(16-21(23)24)27-33(29,30)20-11-12-22(26)17(2)15-20/h10-13,15-16,27H,4-9,14H2,1-3H3