2-[4-(3-oxidanylidene-4-pyridin-3-yl-1H-isoindol-2-yl)phenyl]propanoic acid

Systemtic Name: 2-[4-(3-oxidanylidene-4-pyridin-3-yl-1H-isoindol-2-yl)phenyl]propanoic acid Openeye Name: 2-[4-[1-oxo-7-(3-pyridyl)isoindolin-2-yl]phenyl]propanoic acid CAS Name: 2-[4-[3-oxo-4-(3-pyridinyl)-1H-isoindol-2-yl]phenyl]propanoic acid IUPAC Name: 2-[4-(3-oxo-4-pyridin-3-yl-1H-isoindol-2-yl)phenyl]propanoic acid Traditional Name: 2-[4-[1-keto-7-(3-pyridyl)isoindolin-2-yl]phenyl]propionic acid Formula: C22H18N2O3 MolecularWeight: 358.38992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2CC3=CC=CC(=C3C2=O)C4=CN=CC=C4)C(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)N2CC3=CC=CC(=C3C2=O)C4=CN=CC=C4)C(=O)O

InChI

InChI=1S/C22H18N2O3/c1-14(22(26)27)15-7-9-18(10-8-15)24-13-17-4-2-6-19(20(17)21(24)25)16-5-3-11-23-12-16/h2-12,14H,13H2,1H3,(H,26,27)