4-[2-[(3-oxidanylidene-2-phenyl-1H-isoindol-4-yl)carbonylamino]propanoylamino]butanoic acid

Systemtic Name: 4-[2-[(3-oxidanylidene-2-phenyl-1H-isoindol-4-yl)carbonylamino]propanoylamino]butanoic acid Openeye Name: 4-[2-[(3-oxo-2-phenyl-isoindoline-4-carbonyl)amino]propanoylamino]butanoic acid CAS Name: 4-[[1-oxo-2-[[oxo-(3-oxo-2-phenyl-1H-isoindol-4-yl)methyl]amino]propyl]amino]butanoic acid IUPAC Name: 4-[2-[(3-oxo-2-phenyl-1H-isoindole-4-carbonyl)amino]propanoylamino]butanoic acid Traditional Name: 4-[2-[(3-keto-2-phenyl-isoindoline-4-carbonyl)amino]propanoylamino]butyric acid Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O5/c1-14(20(28)23-12-6-11-18(26)27)24-21(29)17-10-5-7-15-13-25(22(30)19(15)17)16-8-3-2-4-9-16/h2-5,7-10,14H,6,11-13H2,1H3,(H,23,28)(H,24,29)(H,26,27)