methyl 2-[(4-ethanoylphenyl)sulfonylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[(4-ethanoylphenyl)sulfonylamino]-3-methyl-butanoate Openeye Name: methyl 2-[(4-acetylphenyl)sulfonylamino]-3-methyl-butanoate CAS Name: 2-[(4-acetylphenyl)sulfonylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[(4-acetylphenyl)sulfonylamino]-3-methylbutanoate Traditional Name: 2-[(4-acetylphenyl)sulfonylamino]-3-methyl-butyric acid methyl ester Formula: C14H19NO5S MolecularWeight: 313.36936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)C(=O)C

Isomeric SMILES

CC(C)C(C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)C(=O)C

InChI

InChI=1S/C14H19NO5S/c1-9(2)13(14(17)20-4)15-21(18,19)12-7-5-11(6-8-12)10(3)16/h5-9,13,15H,1-4H3