tert-butyl (3R)-3-[[(1S)-2-(methylamino)-2-oxidanylidene-1-phenyl-ethyl]carbamoyl]-6-phenyl-hexanoate

Systemtic Name: tert-butyl (3R)-3-[[(1S)-2-(methylamino)-2-oxidanylidene-1-phenyl-ethyl]carbamoyl]-6-phenyl-hexanoate Openeye Name: tert-butyl (3R)-3-[[(1S)-2-(methylamino)-2-oxo-1-phenyl-ethyl]carbamoyl]-6-phenyl-hexanoate CAS Name: (3R)-3-[[[(1S)-2-(methylamino)-2-oxo-1-phenylethyl]amino]-oxomethyl]-6-phenylhexanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-[[(1S)-2-(methylamino)-2-oxo-1-phenylethyl]carbamoyl]-6-phenylhexanoate Traditional Name: (3R)-3-[[(1S)-2-keto-2-(methylamino)-1-phenyl-ethyl]carbamoyl]-6-phenyl-hexanoic acid tert-butyl ester Formula: C26H34N2O4 MolecularWeight: 438.55916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CCCC1=CC=CC=C1)C(=O)NC(C2=CC=CC=C2)C(=O)NC

Isomeric SMILES

CC(C)(C)OC(=O)C[C@@H](CCCC1=CC=CC=C1)C(=O)N[C@@H](C2=CC=CC=C2)C(=O)NC

InChI

InChI=1S/C26H34N2O4/c1-26(2,3)32-22(29)18-21(17-11-14-19-12-7-5-8-13-19)24(30)28-23(25(31)27-4)20-15-9-6-10-16-20/h5-10,12-13,15-16,21,23H,11,14,17-18H2,1-4H3,(H,27,31)(H,28,30)/t21-,23+/m1/s1