(2S)-3-oxidanylidene-2-pyridin-2-yl-3-(9H-xanthen-9-yl)propanenitrile

Systemtic Name: (2S)-3-oxidanylidene-2-pyridin-2-yl-3-(9H-xanthen-9-yl)propanenitrile Openeye Name: (2S)-3-oxo-2-(2-pyridyl)-3-(9H-xanthen-9-yl)propanenitrile CAS Name: (2S)-3-oxo-2-(2-pyridinyl)-3-(9H-xanthen-9-yl)propanenitrile IUPAC Name: (2S)-3-oxo-2-pyridin-2-yl-3-(9H-xanthen-9-yl)propanenitrile Traditional Name: (2S)-3-keto-2-(2-pyridyl)-3-(9H-xanthen-9-yl)propionitrile Formula: C21H14N2O2 MolecularWeight: 326.34806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)C(C#N)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)[C@H](C#N)C4=CC=CC=N4

InChI

InChI=1S/C21H14N2O2/c22-13-16(17-9-5-6-12-23-17)21(24)20-14-7-1-3-10-18(14)25-19-11-4-2-8-15(19)20/h1-12,16,20H/t16-/m1/s1