methyl 5-(2-methanoylpyrrol-1-yl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: methyl 5-(2-methanoylpyrrol-1-yl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: methyl 5-(2-formylpyrrol-1-yl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-(2-formyl-1-pyrrolyl)-1-phenyl-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-(2-formylpyrrol-1-yl)-1-phenylpyrazole-4-carboxylate Traditional Name: 5-(2-formylpyrrol-1-yl)-1-phenyl-pyrazole-4-carboxylic acid methyl ester Formula: C16H13N3O3 MolecularWeight: 295.29272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=C1)C2=CC=CC=C2)N3C=CC=C3C=O

Isomeric SMILES

COC(=O)C1=C(N(N=C1)C2=CC=CC=C2)N3C=CC=C3C=O

InChI

InChI=1S/C16H13N3O3/c1-22-16(21)14-10-17-19(12-6-3-2-4-7-12)15(14)18-9-5-8-13(18)11-20/h2-11H,1H3