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

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 4-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 4-[2-(3-methoxyanilino)-2-oxo-ethoxy]benzoate CAS Name: 4-[2-(3-methoxyanilino)-2-oxoethoxy]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 4-[2-(3-methoxyanilino)-2-oxoethoxy]benzoate Traditional Name: 4-[2-keto-2-(m-anisidino)ethoxy]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC=C(C=C1)OCC(=O)NC2=CC(=CC=C2)OC

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC=C(C=C1)OCC(=O)NC2=CC(=CC=C2)OC

InChI

InChI=1S/C22H25NO6/c1-22(2,3)19(24)13-29-21(26)15-8-10-17(11-9-15)28-14-20(25)23-16-6-5-7-18(12-16)27-4/h5-12H,13-14H2,1-4H3,(H,23,25)