[2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 3-[(3,4-dimethoxyphenyl)carbonylamino]benzoate

Systemtic Name: [2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 3-[(3,4-dimethoxyphenyl)carbonylamino]benzoate Openeye Name: [2-(2,5-dimethylphenyl)-2-oxo-ethyl] 3-[(3,4-dimethoxybenzoyl)amino]benzoate CAS Name: 3-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]benzoic acid [2-(2,5-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylphenyl)-2-oxoethyl] 3-[(3,4-dimethoxybenzoyl)amino]benzoate Traditional Name: 3-(veratroylamino)benzoic acid [2-(2,5-dimethylphenyl)-2-keto-ethyl] ester Formula: C26H25NO6 MolecularWeight: 447.4798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)COC(=O)C2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)COC(=O)C2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C26H25NO6/c1-16-8-9-17(2)21(12-16)22(28)15-33-26(30)19-6-5-7-20(13-19)27-25(29)18-10-11-23(31-3)24(14-18)32-4/h5-14H,15H2,1-4H3,(H,27,29)