(2-oxidanylidene-2-propan-2-yloxy-ethyl) 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylate

Systemtic Name: (2-oxidanylidene-2-propan-2-yloxy-ethyl) 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylate Openeye Name: (2-isopropoxy-2-oxo-ethyl) 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylate CAS Name: 4-cyano-2-methyl-5-(1-pyrrolyl)-3-furancarboxylic acid (2-oxo-2-propan-2-yloxyethyl) ester IUPAC Name: (2-oxo-2-propan-2-yloxyethyl) 4-cyano-2-methyl-5-pyrrol-1-ylfuran-3-carboxylate Traditional Name: 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylic acid (2-isopropoxy-2-keto-ethyl) ester Formula: C16H16N2O5 MolecularWeight: 316.30864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)OCC(=O)OC(C)C

Isomeric SMILES

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)OCC(=O)OC(C)C

InChI

InChI=1S/C16H16N2O5/c1-10(2)22-13(19)9-21-16(20)14-11(3)23-15(12(14)8-17)18-6-4-5-7-18/h4-7,10H,9H2,1-3H3