tert-butyl 2-[[(4-acetamido-5-chloranyl-2-ethoxy-3-oxidanyl-phenyl)carbonylamino]methyl]morpholine-4-carboxylate

Systemtic Name: tert-butyl 2-[[(4-acetamido-5-chloranyl-2-ethoxy-3-oxidanyl-phenyl)carbonylamino]methyl]morpholine-4-carboxylate Openeye Name: tert-butyl 2-[[(4-acetamido-5-chloro-2-ethoxy-3-hydroxy-benzoyl)amino]methyl]morpholine-4-carboxylate CAS Name: 2-[[[(4-acetamido-5-chloro-2-ethoxy-3-hydroxyphenyl)-oxomethyl]amino]methyl]-4-morpholinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[(4-acetamido-5-chloro-2-ethoxy-3-hydroxybenzoyl)amino]methyl]morpholine-4-carboxylate Traditional Name: 2-[[(4-acetamido-5-chloro-2-ethoxy-3-hydroxy-benzoyl)amino]methyl]morpholine-4-carboxylic acid tert-butyl ester Formula: C21H30ClN3O7 MolecularWeight: 471.9318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C=C1C(=O)NCC2CN(CCO2)C(=O)OC(C)(C)C)Cl)NC(=O)C)O

Isomeric SMILES

CCOC1=C(C(=C(C=C1C(=O)NCC2CN(CCO2)C(=O)OC(C)(C)C)Cl)NC(=O)C)O

InChI

InChI=1S/C21H30ClN3O7/c1-6-30-18-14(9-15(22)16(17(18)27)24-12(2)26)19(28)23-10-13-11-25(7-8-31-13)20(29)32-21(3,4)5/h9,13,27H,6-8,10-11H2,1-5H3,(H,23,28)(H,24,26)