2-(1-isoindol-2-yl-5-oxidanylidene-cyclohex-2-en-1-yl)propanoic acid

Systemtic Name: 2-(1-isoindol-2-yl-5-oxidanylidene-cyclohex-2-en-1-yl)propanoic acid Openeye Name: 2-(1-isoindol-2-yl-5-oxo-cyclohex-2-en-1-yl)propanoic acid CAS Name: 2-[1-(2-isoindolyl)-5-oxo-1-cyclohex-2-enyl]propanoic acid IUPAC Name: 2-(1-isoindol-2-yl-5-oxocyclohex-2-en-1-yl)propanoic acid Traditional Name: 2-(1-isoindol-2-yl-5-keto-cyclohex-2-en-1-yl)propionic acid Formula: C17H17NO3 MolecularWeight: 283.32178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)C1(CC(=O)CC=C1)N2C=C3C=CC=CC3=C2

Isomeric SMILES

CC(C(=O)O)C1(CC(=O)CC=C1)N2C=C3C=CC=CC3=C2

InChI

InChI=1S/C17H17NO3/c1-12(16(20)21)17(8-4-7-15(19)9-17)18-10-13-5-2-3-6-14(13)11-18/h2-6,8,10-12H,7,9H2,1H3,(H,20,21)