[2-[tert-butyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate

Systemtic Name: [2-[tert-butyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: [2-[benzyl(tert-butyl)amino]-2-oxo-ethyl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoic acid [2-[tert-butyl-(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[benzyl(tert-butyl)amino]-2-oxoethyl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]butyric acid [2-[benzyl(tert-butyl)amino]-2-keto-ethyl] ester Formula: C26H34N2O4 MolecularWeight: 438.55916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)N(CC1=CC=CC=C1)C(C)(C)C)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)N(CC1=CC=CC=C1)C(C)(C)C)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C26H34N2O4/c1-19(2)24(27-22(29)16-20-12-8-6-9-13-20)25(31)32-18-23(30)28(26(3,4)5)17-21-14-10-7-11-15-21/h6-15,19,24H,16-18H2,1-5H3,(H,27,29)/t24-/m0/s1