(2-oxidanylidene-2-propan-2-yloxy-ethyl) 2-[3-(4-methoxyphenyl)propanoylamino]benzoate

Systemtic Name: (2-oxidanylidene-2-propan-2-yloxy-ethyl) 2-[3-(4-methoxyphenyl)propanoylamino]benzoate Openeye Name: (2-isopropoxy-2-oxo-ethyl) 2-[3-(4-methoxyphenyl)propanoylamino]benzoate CAS Name: 2-[[3-(4-methoxyphenyl)-1-oxopropyl]amino]benzoic acid (2-oxo-2-propan-2-yloxyethyl) ester IUPAC Name: (2-oxo-2-propan-2-yloxyethyl) 2-[3-(4-methoxyphenyl)propanoylamino]benzoate Traditional Name: 2-[3-(4-methoxyphenyl)propanoylamino]benzoic acid (2-isopropoxy-2-keto-ethyl) ester Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)COC(=O)C1=CC=CC=C1NC(=O)CCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)OC(=O)COC(=O)C1=CC=CC=C1NC(=O)CCC2=CC=C(C=C2)OC

InChI

InChI=1S/C22H25NO6/c1-15(2)29-21(25)14-28-22(26)18-6-4-5-7-19(18)23-20(24)13-10-16-8-11-17(27-3)12-9-16/h4-9,11-12,15H,10,13-14H2,1-3H3,(H,23,24)