3-(4-methoxy-3-propan-2-yloxy-phenyl)-3-(3-oxidanylidene-1H-isoindol-2-yl)propanoic acid

Systemtic Name: 3-(4-methoxy-3-propan-2-yloxy-phenyl)-3-(3-oxidanylidene-1H-isoindol-2-yl)propanoic acid Openeye Name: 3-(3-isopropoxy-4-methoxy-phenyl)-3-(1-oxoisoindolin-2-yl)propanoic acid CAS Name: 3-(4-methoxy-3-propan-2-yloxyphenyl)-3-(3-oxo-1H-isoindol-2-yl)propanoic acid IUPAC Name: 3-(4-methoxy-3-propan-2-yloxyphenyl)-3-(3-oxo-1H-isoindol-2-yl)propanoic acid Traditional Name: 3-(3-isopropoxy-4-methoxy-phenyl)-3-(1-ketoisoindolin-2-yl)propionic acid Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=CC(=C1)C(CC(=O)O)N2CC3=CC=CC=C3C2=O)OC

Isomeric SMILES

CC(C)OC1=C(C=CC(=C1)C(CC(=O)O)N2CC3=CC=CC=C3C2=O)OC

InChI

InChI=1S/C21H23NO5/c1-13(2)27-19-10-14(8-9-18(19)26-3)17(11-20(23)24)22-12-15-6-4-5-7-16(15)21(22)25/h4-10,13,17H,11-12H2,1-3H3,(H,23,24)