(2S)-4-methyl-2-[[(2S)-1-oxidanyl-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]amino]pentanoic acid

Systemtic Name: (2S)-4-methyl-2-[[(2S)-1-oxidanyl-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]amino]pentanoic acid Openeye Name: (2S)-2-[[(1S)-1-[(4-benzyloxyphenyl)methyl]-2-hydroxy-2-oxo-ethyl]amino]-4-methyl-pentanoic acid CAS Name: (2S)-2-[[(2S)-1-hydroxy-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]amino]-4-methylpentanoic acid IUPAC Name: (2S)-2-[[(2S)-1-hydroxy-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]amino]-4-methylpentanoic acid Traditional Name: (2S)-2-[[(1S)-1-(4-benzoxybenzyl)-2-hydroxy-2-keto-ethyl]amino]-4-methyl-valeric acid Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)C[C@@H](C(=O)O)N[C@@H](CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C22H27NO5/c1-15(2)12-19(21(24)25)23-20(22(26)27)13-16-8-10-18(11-9-16)28-14-17-6-4-3-5-7-17/h3-11,15,19-20,23H,12-14H2,1-2H3,(H,24,25)(H,26,27)/t19-,20-/m0/s1