(2S)-3-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-3-oxidanylidene-2-pyridin-2-yl-propanenitrile

Systemtic Name: (2S)-3-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-3-oxidanylidene-2-pyridin-2-yl-propanenitrile Openeye Name: (2S)-3-[3-(2-chlorophenyl)-5-methyl-isoxazol-4-yl]-3-oxo-2-(2-pyridyl)propanenitrile CAS Name: (2S)-3-[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]-3-oxo-2-(2-pyridinyl)propanenitrile IUPAC Name: (2S)-3-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-3-oxo-2-pyridin-2-ylpropanenitrile Traditional Name: (2S)-3-[3-(2-chlorophenyl)-5-methyl-isoxazol-4-yl]-3-keto-2-(2-pyridyl)propionitrile Formula: C18H12ClN3O2 MolecularWeight: 337.75978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)C(C#N)C3=CC=CC=N3

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)[C@H](C#N)C3=CC=CC=N3

InChI

InChI=1S/C18H12ClN3O2/c1-11-16(17(22-24-11)12-6-2-3-7-14(12)19)18(23)13(10-20)15-8-4-5-9-21-15/h2-9,13H,1H3/t13-/m1/s1