tert-butyl (2S)-2-azanyl-5-oxidanylidene-5-[(4-phenylmethoxyphenyl)amino]pentanoate

Systemtic Name: tert-butyl (2S)-2-azanyl-5-oxidanylidene-5-[(4-phenylmethoxyphenyl)amino]pentanoate Openeye Name: tert-butyl (2S)-2-amino-5-(4-benzyloxyanilino)-5-oxo-pentanoate CAS Name: (2S)-2-amino-5-oxo-5-(4-phenylmethoxyanilino)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-amino-5-oxo-5-(4-phenylmethoxyanilino)pentanoate Traditional Name: (2S)-2-amino-5-(4-benzoxyanilino)-5-keto-valeric acid tert-butyl ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCC(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)N

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CCC(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)N

InChI

InChI=1S/C22H28N2O4/c1-22(2,3)28-21(26)19(23)13-14-20(25)24-17-9-11-18(12-10-17)27-15-16-7-5-4-6-8-16/h4-12,19H,13-15,23H2,1-3H3,(H,24,25)/t19-/m0/s1