[2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(dimethylamino)-2-oxo-1-phenyl-ethyl] 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(dimethylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(dimethylamino)-2-oxo-1-phenylethyl] 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(dimethylamino)-2-keto-1-phenyl-ethyl] ester Formula: C15H15BrN2O3 MolecularWeight: 351.1952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(C1=CC=CC=C1)OC(=O)C2=CC(=CN2)Br

Isomeric SMILES

CN(C)C(=O)C(C1=CC=CC=C1)OC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C15H15BrN2O3/c1-18(2)14(19)13(10-6-4-3-5-7-10)21-15(20)12-8-11(16)9-17-12/h3-9,13,17H,1-2H3