[1-cyclohexyl-3-(4-nitrophenyl)aziridin-2-yl]-(2-phenylmethoxyphenyl)methanone

Systemtic Name: [1-cyclohexyl-3-(4-nitrophenyl)aziridin-2-yl]-(2-phenylmethoxyphenyl)methanone Openeye Name: (2-benzyloxyphenyl)-[1-cyclohexyl-3-(4-nitrophenyl)aziridin-2-yl]methanone CAS Name: [1-cyclohexyl-3-(4-nitrophenyl)-2-aziridinyl]-(2-phenylmethoxyphenyl)methanone IUPAC Name: [1-cyclohexyl-3-(4-nitrophenyl)aziridin-2-yl]-(2-phenylmethoxyphenyl)methanone Traditional Name: (2-benzoxyphenyl)-[1-cyclohexyl-3-(4-nitrophenyl)ethylenimin-2-yl]methanone Formula: C28H28N2O4 MolecularWeight: 456.53292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(C2C(=O)C3=CC=CC=C3OCC4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N2C(C2C(=O)C3=CC=CC=C3OCC4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H28N2O4/c31-28(24-13-7-8-14-25(24)34-19-20-9-3-1-4-10-20)27-26(29(27)22-11-5-2-6-12-22)21-15-17-23(18-16-21)30(32)33/h1,3-4,7-10,13-18,22,26-27H,2,5-6,11-12,19H2