[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-(4-tert-butylphenoxy)propanoate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-(4-tert-butylphenoxy)propanoate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 3-(4-tert-butylphenoxy)propanoate CAS Name: 3-(4-tert-butylphenoxy)propanoic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 3-(4-tert-butylphenoxy)propanoate Traditional Name: 3-(4-tert-butylphenoxy)propionic acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C19H23NO4 MolecularWeight: 329.39022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCC(=O)OCC(=O)C2=CC=CN2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCC(=O)OCC(=O)C2=CC=CN2

InChI

InChI=1S/C19H23NO4/c1-19(2,3)14-6-8-15(9-7-14)23-12-10-18(22)24-13-17(21)16-5-4-11-20-16/h4-9,11,20H,10,12-13H2,1-3H3