2-methyl-3-[2-methyl-3-[1-(morpholin-4-ylcarbonylamino)ethylamino]-3-oxidanyl-butan-2-yl]-4-oxidanyl-benzoate

Systemtic Name: 2-methyl-3-[2-methyl-3-[1-(morpholin-4-ylcarbonylamino)ethylamino]-3-oxidanyl-butan-2-yl]-4-oxidanyl-benzoate Openeye Name: 4-hydroxy-3-[2-hydroxy-1,1-dimethyl-2-[1-(morpholine-4-carbonylamino)ethylamino]propyl]-2-methyl-benzoate CAS Name: 4-hydroxy-3-[3-hydroxy-2-methyl-3-[1-[[4-morpholinyl(oxo)methyl]amino]ethylamino]butan-2-yl]-2-methylbenzoate IUPAC Name: 4-hydroxy-3-[3-hydroxy-2-methyl-3-[1-(morpholine-4-carbonylamino)ethylamino]butan-2-yl]-2-methylbenzoate Traditional Name: 4-hydroxy-3-[2-hydroxy-1,1-dimethyl-2-[1-(morpholine-4-carbonylamino)ethylamino]propyl]-2-methyl-benzoate Formula: C20H30N3O6- MolecularWeight: 408.4687

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C(C)(C)C(C)(NC(C)NC(=O)N2CCOCC2)O)O)C(=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1C(C)(C)C(C)(NC(C)NC(=O)N2CCOCC2)O)O)C(=O)[O-]

InChI

InChI=1S/C20H31N3O6/c1-12-14(17(25)26)6-7-15(24)16(12)19(3,4)20(5,28)22-13(2)21-18(27)23-8-10-29-11-9-23/h6-7,13,22,24,28H,8-11H2,1-5H3,(H,21,27)(H,25,26)/p-1