tert-butyl (2S)-2-azanyl-3-(2,4-dimethoxy-3-methyl-5-oxidanyl-phenyl)propanoate

Systemtic Name: tert-butyl (2S)-2-azanyl-3-(2,4-dimethoxy-3-methyl-5-oxidanyl-phenyl)propanoate Openeye Name: tert-butyl (2S)-2-amino-3-(5-hydroxy-2,4-dimethoxy-3-methyl-phenyl)propanoate CAS Name: (2S)-2-amino-3-(5-hydroxy-2,4-dimethoxy-3-methylphenyl)propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-amino-3-(5-hydroxy-2,4-dimethoxy-3-methylphenyl)propanoate Traditional Name: (2S)-2-amino-3-(5-hydroxy-2,4-dimethoxy-3-methyl-phenyl)propionic acid tert-butyl ester Formula: C16H25NO5 MolecularWeight: 311.3734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1OC)O)CC(C(=O)OC(C)(C)C)N)OC

Isomeric SMILES

CC1=C(C(=CC(=C1OC)O)C[C@@H](C(=O)OC(C)(C)C)N)OC

InChI

InChI=1S/C16H25NO5/c1-9-13(20-5)10(8-12(18)14(9)21-6)7-11(17)15(19)22-16(2,3)4/h8,11,18H,7,17H2,1-6H3/t11-/m0/s1