methyl 2-[(4-butan-2-ylphenyl)sulfonylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[(4-butan-2-ylphenyl)sulfonylamino]-3-oxidanyl-propanoate Openeye Name: methyl 3-hydroxy-2-[(4-sec-butylphenyl)sulfonylamino]propanoate CAS Name: 2-[(4-butan-2-ylphenyl)sulfonylamino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-[(4-butan-2-ylphenyl)sulfonylamino]-3-hydroxypropanoate Traditional Name: 3-hydroxy-2-[(4-sec-butylphenyl)sulfonylamino]propionic acid methyl ester Formula: C14H21NO5S MolecularWeight: 315.38524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC(CO)C(=O)OC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC(CO)C(=O)OC

InChI

InChI=1S/C14H21NO5S/c1-4-10(2)11-5-7-12(8-6-11)21(18,19)15-13(9-16)14(17)20-3/h5-8,10,13,15-16H,4,9H2,1-3H3