2-oxidanylidenepropyl 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate

Systemtic Name: 2-oxidanylidenepropyl 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate Openeye Name: acetonyl 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate CAS Name: 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate Traditional Name: 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoic acid acetonyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(=O)COC(=O)C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C21H25NO5S/c1-15(23)14-27-20(24)17-7-5-16(6-8-17)13-22-28(25,26)19-11-9-18(10-12-19)21(2,3)4/h5-12,22H,13-14H2,1-4H3