(2-bromanyl-4-cyano-6-ethoxy-phenyl) 4-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: (2-bromanyl-4-cyano-6-ethoxy-phenyl) 4-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: (2-bromo-4-cyano-6-ethoxy-phenyl) 4-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 4-(2-oxo-1-pyrrolidinyl)benzoic acid (2-bromo-4-cyano-6-ethoxyphenyl) ester IUPAC Name: (2-bromo-4-cyano-6-ethoxyphenyl) 4-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 4-(2-ketopyrrolidino)benzoic acid (2-bromo-4-cyano-6-ethoxy-phenyl) ester Formula: C20H17BrN2O4 MolecularWeight: 429.26398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OC(=O)C2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OC(=O)C2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C20H17BrN2O4/c1-2-26-17-11-13(12-22)10-16(21)19(17)27-20(25)14-5-7-15(8-6-14)23-9-3-4-18(23)24/h5-8,10-11H,2-4,9H2,1H3