(2-morpholin-4-yl-2-oxidanylidene-ethyl) 2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (2-morpholino-2-oxo-ethyl) 2-[(4-tert-butylbenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-methylbutanoic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) 2-[(4-tert-butylbenzoyl)amino]-3-methylbutanoate Traditional Name: 2-[(4-tert-butylbenzoyl)amino]-3-methyl-butyric acid (2-keto-2-morpholino-ethyl) ester Formula: C22H32N2O5 MolecularWeight: 404.49988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)N1CCOCC1)NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C)C(C(=O)OCC(=O)N1CCOCC1)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H32N2O5/c1-15(2)19(21(27)29-14-18(25)24-10-12-28-13-11-24)23-20(26)16-6-8-17(9-7-16)22(3,4)5/h6-9,15,19H,10-14H2,1-5H3,(H,23,26)