methyl 4-(2-iodanylphenyl)carbonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 4-(2-iodanylphenyl)carbonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 4-(2-iodobenzoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[(2-iodophenyl)-oxomethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(2-iodobenzoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-(2-iodobenzoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C15H14INO3 MolecularWeight: 383.18103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C)C(=O)OC)C(=O)C2=CC=CC=C2I

Isomeric SMILES

CC1=C(C(=C(N1)C)C(=O)OC)C(=O)C2=CC=CC=C2I

InChI

InChI=1S/C15H14INO3/c1-8-12(13(9(2)17-8)15(19)20-3)14(18)10-6-4-5-7-11(10)16/h4-7,17H,1-3H3