methyl 3-[[4-(butan-2-ylsulfamoyl)phenyl]amino]-3-oxidanylidene-propanoate

Systemtic Name: methyl 3-[[4-(butan-2-ylsulfamoyl)phenyl]amino]-3-oxidanylidene-propanoate Openeye Name: methyl 3-oxo-3-[4-(sec-butylsulfamoyl)anilino]propanoate CAS Name: 3-[4-(butan-2-ylsulfamoyl)anilino]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-[4-(butan-2-ylsulfamoyl)anilino]-3-oxopropanoate Traditional Name: 3-keto-3-[4-(sec-butylsulfamoyl)anilino]propionic acid methyl ester Formula: C14H20N2O5S MolecularWeight: 328.384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O5S/c1-4-10(2)16-22(19,20)12-7-5-11(6-8-12)15-13(17)9-14(18)21-3/h5-8,10,16H,4,9H2,1-3H3,(H,15,17)