4-methyl-2-[[1-oxidanyl-1-oxidanylidene-3-[3-(pyridin-4-ylmethoxy)phenyl]propan-2-yl]amino]pentanoic acid

Systemtic Name: 4-methyl-2-[[1-oxidanyl-1-oxidanylidene-3-[3-(pyridin-4-ylmethoxy)phenyl]propan-2-yl]amino]pentanoic acid Openeye Name: 2-[[2-hydroxy-2-oxo-1-[[3-(4-pyridylmethoxy)phenyl]methyl]ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[1-hydroxy-1-oxo-3-[3-(pyridin-4-ylmethoxy)phenyl]propan-2-yl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[1-hydroxy-1-oxo-3-[3-(pyridin-4-ylmethoxy)phenyl]propan-2-yl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-hydroxy-2-keto-1-[3-(4-pyridylmethoxy)benzyl]ethyl]amino]-4-methyl-valeric acid Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O5/c1-14(2)10-18(20(24)25)23-19(21(26)27)12-16-4-3-5-17(11-16)28-13-15-6-8-22-9-7-15/h3-9,11,14,18-19,23H,10,12-13H2,1-2H3,(H,24,25)(H,26,27)