2-[[4-methyl-2-[(3-oxidanylidene-2-phenyl-1H-isoindol-4-yl)carbonylamino]pentanoyl]amino]propanoic acid

Systemtic Name: 2-[[4-methyl-2-[(3-oxidanylidene-2-phenyl-1H-isoindol-4-yl)carbonylamino]pentanoyl]amino]propanoic acid Openeye Name: 2-[[4-methyl-2-[(3-oxo-2-phenyl-isoindoline-4-carbonyl)amino]pentanoyl]amino]propanoic acid CAS Name: 2-[[4-methyl-1-oxo-2-[[oxo-(3-oxo-2-phenyl-1H-isoindol-4-yl)methyl]amino]pentyl]amino]propanoic acid IUPAC Name: 2-[[4-methyl-2-[(3-oxo-2-phenyl-1H-isoindole-4-carbonyl)amino]pentanoyl]amino]propanoic acid Traditional Name: 2-[[2-[(3-keto-2-phenyl-isoindoline-4-carbonyl)amino]-4-methyl-pentanoyl]amino]propionic acid Formula: C24H27N3O5 MolecularWeight: 437.48828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C)C(=O)O)NC(=O)C1=C2C(=CC=C1)CN(C2=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C(=O)NC(C)C(=O)O)NC(=O)C1=C2C(=CC=C1)CN(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C24H27N3O5/c1-14(2)12-19(22(29)25-15(3)24(31)32)26-21(28)18-11-7-8-16-13-27(23(30)20(16)18)17-9-5-4-6-10-17/h4-11,14-15,19H,12-13H2,1-3H3,(H,25,29)(H,26,28)(H,31,32)