3,5-dimethyl-4-[(2S)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]oxy-benzoate

Systemtic Name: 3,5-dimethyl-4-[(2S)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]oxy-benzoate Openeye Name: 3,5-dimethyl-4-[(1S)-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethoxy]benzoate CAS Name: 3,5-dimethyl-4-[(2S)-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]oxybenzoate IUPAC Name: 3,5-dimethyl-4-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]oxybenzoate Traditional Name: 4-[(1S)-2-keto-1-methyl-2-pyrrolidino-ethoxy]-3,5-dimethyl-benzoate Formula: C16H20NO4- MolecularWeight: 290.3343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(C)C(=O)N2CCCC2)C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1O[C@@H](C)C(=O)N2CCCC2)C)C(=O)[O-]

InChI

InChI=1S/C16H21NO4/c1-10-8-13(16(19)20)9-11(2)14(10)21-12(3)15(18)17-6-4-5-7-17/h8-9,12H,4-7H2,1-3H3,(H,19,20)/p-1/t12-/m0/s1