[(2E)-2-bromanyl-2-(1-ethanoyl-3,3-dimethyl-aziridin-2-ylidene)-1-phenyl-ethyl] ethanoate

Systemtic Name: [(2E)-2-bromanyl-2-(1-ethanoyl-3,3-dimethyl-aziridin-2-ylidene)-1-phenyl-ethyl] ethanoate Openeye Name: [(2E)-2-(1-acetyl-3,3-dimethyl-aziridin-2-ylidene)-2-bromo-1-phenyl-ethyl] acetate CAS Name: acetic acid [(2E)-2-(1-acetyl-3,3-dimethyl-2-aziridinylidene)-2-bromo-1-phenylethyl] ester IUPAC Name: [(2E)-2-(1-acetyl-3,3-dimethylaziridin-2-ylidene)-2-bromo-1-phenylethyl] acetate Traditional Name: acetic acid [(2E)-2-(1-acetyl-3,3-dimethyl-ethylenimin-2-ylidene)-2-bromo-1-phenyl-ethyl] ester Formula: C16H18BrNO3 MolecularWeight: 352.22302

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(=C(C(C2=CC=CC=C2)OC(=O)C)Br)C1(C)C

Isomeric SMILES

CC(=O)N1/C(=C(\C(C2=CC=CC=C2)OC(=O)C)/Br)/C1(C)C

InChI

InChI=1S/C16H18BrNO3/c1-10(19)18-15(16(18,3)4)13(17)14(21-11(2)20)12-8-6-5-7-9-12/h5-9,14H,1-4H3/b15-13+