[1-[(2,6-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-4-(4-pentoxyphenyl)butanoate

Systemtic Name: [1-[(2,6-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-4-(4-pentoxyphenyl)butanoate Openeye Name: [2-(2,6-dimethylanilino)-1-methyl-2-oxo-ethyl] 4-oxo-4-(4-pentoxyphenyl)butanoate CAS Name: 4-oxo-4-(4-pentoxyphenyl)butanoic acid [1-(2,6-dimethylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,6-dimethylanilino)-1-oxopropan-2-yl] 4-oxo-4-(4-pentoxyphenyl)butanoate Traditional Name: 4-(4-amoxyphenyl)-4-keto-butyric acid [2-(2,6-dimethylanilino)-2-keto-1-methyl-ethyl] ester Formula: C26H33NO5 MolecularWeight: 439.54392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)CCC(=O)OC(C)C(=O)NC2=C(C=CC=C2C)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)CCC(=O)OC(C)C(=O)NC2=C(C=CC=C2C)C

InChI

InChI=1S/C26H33NO5/c1-5-6-7-17-31-22-13-11-21(12-14-22)23(28)15-16-24(29)32-20(4)26(30)27-25-18(2)9-8-10-19(25)3/h8-14,20H,5-7,15-17H2,1-4H3,(H,27,30)