methyl (2S)-2-[[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-formamido-propanoyl]amino]propanoate

Systemtic Name: methyl (2S)-2-[[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-formamido-propanoyl]amino]propanoate Openeye Name: methyl (2S)-2-[[3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-formamido-propanoyl]amino]propanoate CAS Name: (2S)-2-[[3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-formamido-1-oxopropyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-formamidopropanoyl]amino]propanoate Traditional Name: (2S)-2-[[3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-formamido-propanoyl]amino]propionic acid methyl ester Formula: C22H34N2O5 MolecularWeight: 406.51576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)C(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)NC=O

Isomeric SMILES

C[C@@H](C(=O)OC)NC(=O)C(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)NC=O

InChI

InChI=1S/C22H34N2O5/c1-13(20(28)29-8)24-19(27)17(23-12-25)11-14-9-15(21(2,3)4)18(26)16(10-14)22(5,6)7/h9-10,12-13,17,26H,11H2,1-8H3,(H,23,25)(H,24,27)/t13-,17?/m0/s1