tert-butyl (3R)-3-[[(2S)-1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]-8-oxidanyl-octanoate

Systemtic Name: tert-butyl (3R)-3-[[(2S)-1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]-8-oxidanyl-octanoate Openeye Name: tert-butyl (3R)-3-[[(1S)-1-benzyl-2-(methylamino)-2-oxo-ethyl]carbamoyl]-8-hydroxy-octanoate CAS Name: (3R)-8-hydroxy-3-[[[(2S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]octanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-8-hydroxy-3-[[(2S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]octanoate Traditional Name: (3R)-3-[[(1S)-1-benzyl-2-keto-2-(methylamino)ethyl]carbamoyl]-8-hydroxy-caprylic acid tert-butyl ester Formula: C23H36N2O5 MolecularWeight: 420.54234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H36N2O5/c1-23(2,3)30-20(27)16-18(13-9-6-10-14-26)21(28)25-19(22(29)24-4)15-17-11-7-5-8-12-17/h5,7-8,11-12,18-19,26H,6,9-10,13-16H2,1-4H3,(H,24,29)(H,25,28)/t18-,19+/m1/s1