(3,3-dimethyl-2-oxidanylidene-butyl) 2-[[4-(morpholin-4-ylmethyl)phenyl]carbonylamino]benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[[4-(morpholin-4-ylmethyl)phenyl]carbonylamino]benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[[4-(morpholinomethyl)benzoyl]amino]benzoate CAS Name: 2-[[[4-(4-morpholinylmethyl)phenyl]-oxomethyl]amino]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[[4-(morpholin-4-ylmethyl)benzoyl]amino]benzoate Traditional Name: 2-[[4-(morpholinomethyl)benzoyl]amino]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C25H30N2O5 MolecularWeight: 438.5161

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CN3CCOCC3

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CN3CCOCC3

InChI

InChI=1S/C25H30N2O5/c1-25(2,3)22(28)17-32-24(30)20-6-4-5-7-21(20)26-23(29)19-10-8-18(9-11-19)16-27-12-14-31-15-13-27/h4-11H,12-17H2,1-3H3,(H,26,29)