4-methyl-2-[[3-phenyl-2-[2-(pyrrolidin-2-ylcarbonylamino)ethanoylamino]propanoyl]amino]pentanoic acid

Systemtic Name: 4-methyl-2-[[3-phenyl-2-[2-(pyrrolidin-2-ylcarbonylamino)ethanoylamino]propanoyl]amino]pentanoic acid Openeye Name: 4-methyl-2-[[3-phenyl-2-[[2-(pyrrolidine-2-carbonylamino)acetyl]amino]propanoyl]amino]pentanoic acid CAS Name: 4-methyl-2-[[1-oxo-2-[[1-oxo-2-[[oxo(2-pyrrolidinyl)methyl]amino]ethyl]amino]-3-phenylpropyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[[3-phenyl-2-[[2-(pyrrolidine-2-carbonylamino)acetyl]amino]propanoyl]amino]pentanoic acid Traditional Name: 4-methyl-2-[[3-phenyl-2-[[2-(prolylamino)acetyl]amino]propanoyl]amino]valeric acid Formula: C22H32N4O5 MolecularWeight: 432.51328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C2CCCN2

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C2CCCN2

InChI

InChI=1S/C22H32N4O5/c1-14(2)11-18(22(30)31)26-21(29)17(12-15-7-4-3-5-8-15)25-19(27)13-24-20(28)16-9-6-10-23-16/h3-5,7-8,14,16-18,23H,6,9-13H2,1-2H3,(H,24,28)(H,25,27)(H,26,29)(H,30,31)