3,5-dimethyl-4-[2-(methylamino)-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: 3,5-dimethyl-4-[2-(methylamino)-2-oxidanylidene-ethoxy]benzoate Openeye Name: 3,5-dimethyl-4-[2-(methylamino)-2-oxo-ethoxy]benzoate CAS Name: 3,5-dimethyl-4-[2-(methylamino)-2-oxoethoxy]benzoate IUPAC Name: 3,5-dimethyl-4-[2-(methylamino)-2-oxoethoxy]benzoate Traditional Name: 4-[2-keto-2-(methylamino)ethoxy]-3,5-dimethyl-benzoate Formula: C12H14NO4- MolecularWeight: 236.24386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC)C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC)C)C(=O)[O-]

InChI

InChI=1S/C12H15NO4/c1-7-4-9(12(15)16)5-8(2)11(7)17-6-10(14)13-3/h4-5H,6H2,1-3H3,(H,13,14)(H,15,16)/p-1