(phenylmethyl) 5-[(4-tert-butylphenyl)sulfonylamino]-2,6-dimethyl-1-benzofuran-3-carboxylate

Systemtic Name: (phenylmethyl) 5-[(4-tert-butylphenyl)sulfonylamino]-2,6-dimethyl-1-benzofuran-3-carboxylate Openeye Name: benzyl 5-[(4-tert-butylphenyl)sulfonylamino]-2,6-dimethyl-benzofuran-3-carboxylate CAS Name: 5-[(4-tert-butylphenyl)sulfonylamino]-2,6-dimethyl-3-benzofurancarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-[(4-tert-butylphenyl)sulfonylamino]-2,6-dimethyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-tert-butylphenyl)sulfonylamino]-2,6-dimethyl-benzofuran-3-carboxylic acid benzyl ester Formula: C28H29NO5S MolecularWeight: 491.59856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=C2C(=O)OCC3=CC=CC=C3)C)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=C2C(=O)OCC3=CC=CC=C3)C)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C28H29NO5S/c1-18-15-25-23(26(19(2)34-25)27(30)33-17-20-9-7-6-8-10-20)16-24(18)29-35(31,32)22-13-11-21(12-14-22)28(3,4)5/h6-16,29H,17H2,1-5H3