3-(4-ethylphenyl)-3-(3-oxidanylidene-1H-isoindol-2-yl)propanoic acid

Systemtic Name: 3-(4-ethylphenyl)-3-(3-oxidanylidene-1H-isoindol-2-yl)propanoic acid Openeye Name: 3-(4-ethylphenyl)-3-(1-oxoisoindolin-2-yl)propanoic acid CAS Name: 3-(4-ethylphenyl)-3-(3-oxo-1H-isoindol-2-yl)propanoic acid IUPAC Name: 3-(4-ethylphenyl)-3-(3-oxo-1H-isoindol-2-yl)propanoic acid Traditional Name: 3-(4-ethylphenyl)-3-(1-ketoisoindolin-2-yl)propionic acid Formula: C19H19NO3 MolecularWeight: 309.35906

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CC(=O)O)N2CC3=CC=CC=C3C2=O

Isomeric SMILES

CCC1=CC=C(C=C1)C(CC(=O)O)N2CC3=CC=CC=C3C2=O

InChI

InChI=1S/C19H19NO3/c1-2-13-7-9-14(10-8-13)17(11-18(21)22)20-12-15-5-3-4-6-16(15)19(20)23/h3-10,17H,2,11-12H2,1H3,(H,21,22)