octyl 2-methyl-5-[(4-propan-2-ylphenyl)sulfonylamino]-1-benzofuran-3-carboxylate

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

Click to see the large picture

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

Isomeric SMILES

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

InChI

InChI=1S/C27H35NO5S/c1-5-6-7-8-9-10-17-32-27(29)26-20(4)33-25-16-13-22(18-24(25)26)28-34(30,31)23-14-11-21(12-15-23)19(2)3/h11-16,18-19,28H,5-10,17H2,1-4H3