(4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-[(3,4-dimethylphenyl)sulfonylamino]ethanoate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-[(3,4-dimethylphenyl)sulfonylamino]ethanoate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-[(3,4-dimethylphenyl)sulfonylamino]acetate CAS Name: 2-[(3,4-dimethylphenyl)sulfonylamino]acetic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 2-[(3,4-dimethylphenyl)sulfonylamino]acetate Traditional Name: 2-[(3,4-dimethylphenyl)sulfonylamino]acetic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C23H31NO4S MolecularWeight: 417.56154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC2=C(C=C(C=C2C)C(C)(C)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC2=C(C=C(C=C2C)C(C)(C)C)C)C

InChI

InChI=1S/C23H31NO4S/c1-15-8-9-20(12-16(15)2)29(26,27)24-13-22(25)28-14-21-17(3)10-19(11-18(21)4)23(5,6)7/h8-12,24H,13-14H2,1-7H3