3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]benzonitrile CAS Name: 3-[[(2S,6S)-2,6-dimethyl-4-morpholinyl]-oxomethyl]benzonitrile IUPAC Name: 3-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]benzonitrile Traditional Name: 3-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]benzonitrile Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)C(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C14H16N2O2/c1-10-8-16(9-11(2)18-10)14(17)13-5-3-4-12(6-13)7-15/h3-6,10-11H,8-9H2,1-2H3/t10-,11-/m0/s1