[(2R,3R)-3-(4-chlorophenyl)aziridin-1-ium-2-yl]-(2-phenylmethoxyphenyl)methanone

Systemtic Name: [(2R,3R)-3-(4-chlorophenyl)aziridin-1-ium-2-yl]-(2-phenylmethoxyphenyl)methanone Openeye Name: (2-benzyloxyphenyl)-[(2R,3R)-3-(4-chlorophenyl)aziridin-1-ium-2-yl]methanone CAS Name: [(2R,3R)-3-(4-chlorophenyl)-2-aziridin-1-iumyl]-(2-phenylmethoxyphenyl)methanone IUPAC Name: [(2R,3R)-3-(4-chlorophenyl)aziridin-1-ium-2-yl]-(2-phenylmethoxyphenyl)methanone Traditional Name: (2-benzoxyphenyl)-[(2R,3R)-3-(4-chlorophenyl)ethylenimin-1-ium-2-yl]methanone Formula: C22H19ClNO2+ MolecularWeight: 364.84476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC=C2C(=O)C3C([NH2+]3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC=C2C(=O)[C@H]3[C@H]([NH2+]3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H18ClNO2/c23-17-12-10-16(11-13-17)20-21(24-20)22(25)18-8-4-5-9-19(18)26-14-15-6-2-1-3-7-15/h1-13,20-21,24H,14H2/p+1/t20-,21-/m1/s1