4-methyl-2-[2-[2-(pyridin-3-ylcarbonylamino)phenyl]ethanoylamino]pentanoic acid

Systemtic Name: 4-methyl-2-[2-[2-(pyridin-3-ylcarbonylamino)phenyl]ethanoylamino]pentanoic acid Openeye Name: 4-methyl-2-[[2-[2-(pyridine-3-carbonylamino)phenyl]acetyl]amino]pentanoic acid CAS Name: 4-methyl-2-[[1-oxo-2-[2-[[oxo(3-pyridinyl)methyl]amino]phenyl]ethyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[[2-[2-(pyridine-3-carbonylamino)phenyl]acetyl]amino]pentanoic acid Traditional Name: 4-methyl-2-[[2-(2-nicotinamidophenyl)acetyl]amino]valeric acid Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)CC1=CC=CC=C1NC(=O)C2=CN=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)CC1=CC=CC=C1NC(=O)C2=CN=CC=C2

InChI

InChI=1S/C20H23N3O4/c1-13(2)10-17(20(26)27)22-18(24)11-14-6-3-4-8-16(14)23-19(25)15-7-5-9-21-12-15/h3-9,12-13,17H,10-11H2,1-2H3,(H,22,24)(H,23,25)(H,26,27)