3-oxidanylidenebutan-2-yl 4-(thiophen-2-ylcarbonylamino)benzoate

Systemtic Name: 3-oxidanylidenebutan-2-yl 4-(thiophen-2-ylcarbonylamino)benzoate Openeye Name: (1-methyl-2-oxo-propyl) 4-(thiophene-2-carbonylamino)benzoate CAS Name: 4-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid 3-oxobutan-2-yl ester IUPAC Name: 3-oxobutan-2-yl 4-(thiophene-2-carbonylamino)benzoate Traditional Name: 4-(2-thenoylamino)benzoic acid (2-keto-1-methyl-propyl) ester Formula: C16H15NO4S MolecularWeight: 317.3596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)OC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CS2

Isomeric SMILES

CC(C(=O)C)OC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CS2

InChI

InChI=1S/C16H15NO4S/c1-10(18)11(2)21-16(20)12-5-7-13(8-6-12)17-15(19)14-4-3-9-22-14/h3-9,11H,1-2H3,(H,17,19)