(E)-3-[3-[2-(2,4-dimethylphenoxy)-2-ethyl-3-oxidanylidene-aziridin-1-yl]phenyl]-2-isocyano-pent-2-enedinitrile

Systemtic Name: (E)-3-[3-[2-(2,4-dimethylphenoxy)-2-ethyl-3-oxidanylidene-aziridin-1-yl]phenyl]-2-isocyano-pent-2-enedinitrile Openeye Name: (E)-3-[3-[2-(2,4-dimethylphenoxy)-2-ethyl-3-oxo-aziridin-1-yl]phenyl]-2-isocyano-pent-2-enedinitrile CAS Name: (E)-3-[3-[2-(2,4-dimethylphenoxy)-2-ethyl-3-oxo-1-aziridinyl]phenyl]-2-isocyano-2-pentenedinitrile IUPAC Name: (E)-3-[3-[2-(2,4-dimethylphenoxy)-2-ethyl-3-oxoaziridin-1-yl]phenyl]-2-isocyanopent-2-enedinitrile Traditional Name: (E)-3-[3-[2-(2,4-dimethylphenoxy)-2-ethyl-3-keto-ethylenimin-1-yl]phenyl]-2-isocyano-pent-2-enedinitrile Formula: C24H20N4O2 MolecularWeight: 396.4412

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)N1C2=CC=CC(=C2)C(=C(C#N)[N+]#[C-])CC#N)OC3=C(C=C(C=C3)C)C

Isomeric SMILES

CCC1(C(=O)N1C2=CC=CC(=C2)/C(=C(\C#N)/[N+]#[C-])/CC#N)OC3=C(C=C(C=C3)C)C

InChI

InChI=1S/C24H20N4O2/c1-5-24(30-22-10-9-16(2)13-17(22)3)23(29)28(24)19-8-6-7-18(14-19)20(11-12-25)21(15-26)27-4/h6-10,13-14H,5,11H2,1-3H3/b21-20+