(3-bromanyl-4-methoxy-phenyl)methyl 3-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: (3-bromanyl-4-methoxy-phenyl)methyl 3-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: (3-bromo-4-methoxy-phenyl)methyl 3-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 3-(2-oxo-1-pyrrolidinyl)benzoic acid (3-bromo-4-methoxyphenyl)methyl ester IUPAC Name: (3-bromo-4-methoxyphenyl)methyl 3-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 3-(2-ketopyrrolidino)benzoic acid (3-bromo-4-methoxy-benzyl) ester Formula: C19H18BrNO4 MolecularWeight: 404.25452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C2=CC(=CC=C2)N3CCCC3=O)Br

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)C2=CC(=CC=C2)N3CCCC3=O)Br

InChI

InChI=1S/C19H18BrNO4/c1-24-17-8-7-13(10-16(17)20)12-25-19(23)14-4-2-5-15(11-14)21-9-3-6-18(21)22/h2,4-5,7-8,10-11H,3,6,9,12H2,1H3