(2,3,6-trimethylphenyl) 1-(4-bromophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (2,3,6-trimethylphenyl) 1-(4-bromophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (2,3,6-trimethylphenyl) 1-(4-bromophenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(4-bromophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (2,3,6-trimethylphenyl) ester IUPAC Name: (2,3,6-trimethylphenyl) 1-(4-bromophenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-(4-bromophenyl)-5-keto-pyrrolidine-3-carboxylic acid (2,3,6-trimethylphenyl) ester Formula: C20H20BrNO3 MolecularWeight: 402.2817

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C20H20BrNO3/c1-12-4-5-13(2)19(14(12)3)25-20(24)15-10-18(23)22(11-15)17-8-6-16(21)7-9-17/h4-9,15H,10-11H2,1-3H3