(3,3-dimethyl-2-oxidanylidene-butyl) 2-[3-(4-methoxyphenyl)propanoylamino]benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[3-(4-methoxyphenyl)propanoylamino]benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[3-(4-methoxyphenyl)propanoylamino]benzoate CAS Name: 2-[[3-(4-methoxyphenyl)-1-oxopropyl]amino]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[3-(4-methoxyphenyl)propanoylamino]benzoate Traditional Name: 2-[3-(4-methoxyphenyl)propanoylamino]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27NO5/c1-23(2,3)20(25)15-29-22(27)18-7-5-6-8-19(18)24-21(26)14-11-16-9-12-17(28-4)13-10-16/h5-10,12-13H,11,14-15H2,1-4H3,(H,24,26)