(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 4-bromanyl-3,5-dimethoxy-benzoate

Systemtic Name: (1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 4-bromanyl-3,5-dimethoxy-benzoate Openeye Name: (1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl) 4-bromo-3,5-dimethoxy-benzoate CAS Name: 4-bromo-3,5-dimethoxybenzoic acid [1-oxo-1-(1-pyrrolidinyl)propan-2-yl] ester IUPAC Name: (1-oxo-1-pyrrolidin-1-ylpropan-2-yl) 4-bromo-3,5-dimethoxybenzoate Traditional Name: 4-bromo-3,5-dimethoxy-benzoic acid (2-keto-1-methyl-2-pyrrolidino-ethyl) ester Formula: C16H20BrNO5 MolecularWeight: 386.2377

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)OC(=O)C2=CC(=C(C(=C2)OC)Br)OC

Isomeric SMILES

CC(C(=O)N1CCCC1)OC(=O)C2=CC(=C(C(=C2)OC)Br)OC

InChI

InChI=1S/C16H20BrNO5/c1-10(15(19)18-6-4-5-7-18)23-16(20)11-8-12(21-2)14(17)13(9-11)22-3/h8-10H,4-7H2,1-3H3