(3S)-3-(3-oxidanylidene-1H-isoindol-2-yl)-3-phenyl-propanoate

Systemtic Name: (3S)-3-(3-oxidanylidene-1H-isoindol-2-yl)-3-phenyl-propanoate Openeye Name: (3S)-3-(1-oxoisoindolin-2-yl)-3-phenyl-propanoate CAS Name: (3S)-3-(3-oxo-1H-isoindol-2-yl)-3-phenylpropanoate IUPAC Name: (3S)-3-(3-oxo-1H-isoindol-2-yl)-3-phenylpropanoate Traditional Name: (3S)-3-(1-ketoisoindolin-2-yl)-3-phenyl-propionate Formula: C17H14NO3- MolecularWeight: 280.29796

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N1C(CC(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N1[C@@H](CC(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C17H15NO3/c19-16(20)10-15(12-6-2-1-3-7-12)18-11-13-8-4-5-9-14(13)17(18)21/h1-9,15H,10-11H2,(H,19,20)/p-1/t15-/m0/s1