methyl 4-[3,3-bis(chloranyl)-1-phenyl-aziridin-2-yl]benzoate

Systemtic Name: methyl 4-[3,3-bis(chloranyl)-1-phenyl-aziridin-2-yl]benzoate Openeye Name: methyl 4-(3,3-dichloro-1-phenyl-aziridin-2-yl)benzoate CAS Name: 4-(3,3-dichloro-1-phenyl-2-aziridinyl)benzoic acid methyl ester IUPAC Name: methyl 4-(3,3-dichloro-1-phenylaziridin-2-yl)benzoate Traditional Name: 4-(3,3-dichloro-1-phenyl-ethylenimin-2-yl)benzoic acid methyl ester Formula: C16H13Cl2NO2 MolecularWeight: 322.18592

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2C(N2C3=CC=CC=C3)(Cl)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2C(N2C3=CC=CC=C3)(Cl)Cl

InChI

InChI=1S/C16H13Cl2NO2/c1-21-15(20)12-9-7-11(8-10-12)14-16(17,18)19(14)13-5-3-2-4-6-13/h2-10,14H,1H3