(6-bromanyl-1,3-benzodioxol-5-yl)methyl 4-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 4-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 4-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 4-(2-oxo-1-pyrrolidinyl)benzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 4-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 4-(2-ketopyrrolidino)benzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C19H16BrNO5 MolecularWeight: 418.23804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)OCC3=CC4=C(C=C3Br)OCO4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)OCC3=CC4=C(C=C3Br)OCO4

InChI

InChI=1S/C19H16BrNO5/c20-15-9-17-16(25-11-26-17)8-13(15)10-24-19(23)12-3-5-14(6-4-12)21-7-1-2-18(21)22/h3-6,8-9H,1-2,7,10-11H2