(4-bromanyl-2-chloranyl-phenyl) 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (4-bromanyl-2-chloranyl-phenyl) 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (4-bromo-2-chloro-phenyl) 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-3-pyrrolidinecarboxylic acid (4-bromo-2-chlorophenyl) ester IUPAC Name: (4-bromo-2-chlorophenyl) 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-keto-pyrrolidine-3-carboxylic acid (4-bromo-2-chloro-phenyl) ester Formula: C19H15BrClNO5 MolecularWeight: 452.6831

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N3CC(CC3=O)C(=O)OC4=C(C=C(C=C4)Br)Cl

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N3CC(CC3=O)C(=O)OC4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C19H15BrClNO5/c20-12-1-3-15(14(21)8-12)27-19(24)11-7-18(23)22(10-11)13-2-4-16-17(9-13)26-6-5-25-16/h1-4,8-9,11H,5-7,10H2