(3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate

Systemtic Name: (3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate Openeye Name: (3-acetyl-2,4,6-trimethyl-phenyl)methyl 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate CAS Name: 4,5-dimethoxy-2-[(2-methyl-1-oxopropyl)amino]benzoic acid (3-acetyl-2,4,6-trimethylphenyl)methyl ester IUPAC Name: (3-acetyl-2,4,6-trimethylphenyl)methyl 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate Traditional Name: 2-(isobutyrylamino)-4,5-dimethoxy-benzoic acid (3-acetyl-2,4,6-trimethyl-benzyl) ester Formula: C25H31NO6 MolecularWeight: 441.51674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)C2=CC(=C(C=C2NC(=O)C(C)C)OC)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)C2=CC(=C(C=C2NC(=O)C(C)C)OC)OC)C

InChI

InChI=1S/C25H31NO6/c1-13(2)24(28)26-20-11-22(31-8)21(30-7)10-18(20)25(29)32-12-19-14(3)9-15(4)23(16(19)5)17(6)27/h9-11,13H,12H2,1-8H3,(H,26,28)