4-[(2R,3R)-3-(phenylcarbonyl)aziridin-2-yl]benzenecarbonitrile

Systemtic Name: 4-[(2R,3R)-3-(phenylcarbonyl)aziridin-2-yl]benzenecarbonitrile Openeye Name: 4-[(2R,3R)-3-benzoylaziridin-2-yl]benzonitrile CAS Name: 4-[(2R,3R)-3-benzoyl-2-aziridinyl]benzonitrile IUPAC Name: 4-[(2R,3R)-3-benzoylaziridin-2-yl]benzonitrile Traditional Name: 4-[(2R,3R)-3-benzoylethylenimin-2-yl]benzonitrile Formula: C16H12N2O MolecularWeight: 248.27928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2C(N2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)[C@H]2[C@H](N2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H12N2O/c17-10-11-6-8-12(9-7-11)14-15(18-14)16(19)13-4-2-1-3-5-13/h1-9,14-15,18H/t14-,15-/m1/s1