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

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[3-(3,4-dimethoxyphenyl)propanoylamino]benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[3-(3,4-dimethoxyphenyl)propanoylamino]benzoate CAS Name: 2-[[3-(3,4-dimethoxyphenyl)-1-oxopropyl]amino]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[3-(3,4-dimethoxyphenyl)propanoylamino]benzoate Traditional Name: 2-[3-(3,4-dimethoxyphenyl)propanoylamino]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C24H29NO6 MolecularWeight: 427.49016

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C24H29NO6/c1-24(2,3)21(26)15-31-23(28)17-8-6-7-9-18(17)25-22(27)13-11-16-10-12-19(29-4)20(14-16)30-5/h6-10,12,14H,11,13,15H2,1-5H3,(H,25,27)