(4-oxidanylidene-4-thiophen-2-yl-butyl) 4-ethanoyl-1H-pyrrole-2-carboxylate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 4-ethanoyl-1H-pyrrole-2-carboxylate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 4-acetyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-1H-pyrrole-2-carboxylic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 4-acetyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C15H15NO4S MolecularWeight: 305.3489

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)OCCCC(=O)C2=CC=CS2

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)OCCCC(=O)C2=CC=CS2

InChI

InChI=1S/C15H15NO4S/c1-10(17)11-8-12(16-9-11)15(19)20-6-2-4-13(18)14-5-3-7-21-14/h3,5,7-9,16H,2,4,6H2,1H3