(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-acetyl-1-methyl-pyrrole-2-carboxylate CAS Name: 4-acetyl-1-methyl-2-pyrrolecarboxylic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-acetyl-1-methylpyrrole-2-carboxylate Traditional Name: 4-acetyl-1-methyl-pyrrole-2-carboxylic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C17H15N3O4 MolecularWeight: 325.3187

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C(=C1)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3)C

Isomeric SMILES

CC(=O)C1=CN(C(=C1)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3)C

InChI

InChI=1S/C17H15N3O4/c1-11(21)13-8-14(20(2)9-13)17(22)23-10-15-18-16(19-24-15)12-6-4-3-5-7-12/h3-9H,10H2,1-2H3