4-[3-(2-phenylaziridin-1-yl)propyl]benzenecarbonitrile

Systemtic Name: 4-[3-(2-phenylaziridin-1-yl)propyl]benzenecarbonitrile Openeye Name: 4-[3-(2-phenylaziridin-1-yl)propyl]benzonitrile CAS Name: 4-[3-(2-phenyl-1-aziridinyl)propyl]benzonitrile IUPAC Name: 4-[3-(2-phenylaziridin-1-yl)propyl]benzonitrile Traditional Name: 4-[3-(2-phenylethylenimin-1-yl)propyl]benzonitrile Formula: C18H18N2 MolecularWeight: 262.34892

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N1CCCC2=CC=C(C=C2)C#N)C3=CC=CC=C3

Isomeric SMILES

C1C(N1CCCC2=CC=C(C=C2)C#N)C3=CC=CC=C3

InChI

InChI=1S/C18H18N2/c19-13-16-10-8-15(9-11-16)5-4-12-20-14-18(20)17-6-2-1-3-7-17/h1-3,6-11,18H,4-5,12,14H2