3-oxidanylidene-2-phenethyl-1H-isoindole-4-carboxylic acid

Systemtic Name: 3-oxidanylidene-2-phenethyl-1H-isoindole-4-carboxylic acid Openeye Name: 3-oxo-2-phenethyl-isoindoline-4-carboxylic acid CAS Name: 3-oxo-2-phenethyl-1H-isoindole-4-carboxylic acid IUPAC Name: 3-oxo-2-phenethyl-1H-isoindole-4-carboxylic acid Traditional Name: 3-keto-2-phenethyl-isoindoline-4-carboxylic acid Formula: C17H15NO3 MolecularWeight: 281.3059

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC(=C2C(=O)N1CCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1C2=CC=CC(=C2C(=O)N1CCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C17H15NO3/c19-16-15-13(7-4-8-14(15)17(20)21)11-18(16)10-9-12-5-2-1-3-6-12/h1-8H,9-11H2,(H,20,21)