3-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-propoxy-phenyl]propanoic acid

Systemtic Name: 3-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-propoxy-phenyl]propanoic acid Openeye Name: 3-[3-(1,3-dioxoisoindolin-2-yl)-4-propoxy-phenyl]propanoic acid CAS Name: 3-[3-(1,3-dioxo-2-isoindolyl)-4-propoxyphenyl]propanoic acid IUPAC Name: 3-[3-(1,3-dioxoisoindol-2-yl)-4-propoxyphenyl]propanoic acid Traditional Name: 3-(3-phthalimido-4-propoxy-phenyl)propionic acid Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CCC(=O)O)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CCC(=O)O)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H19NO5/c1-2-11-26-17-9-7-13(8-10-18(22)23)12-16(17)21-19(24)14-5-3-4-6-15(14)20(21)25/h3-7,9,12H,2,8,10-11H2,1H3,(H,22,23)