3-[2-methoxy-5-(2-methylbutan-2-yl)phenyl]-4-nitro-2,5-diphenyl-1,2-oxazolidine

Systemtic Name: 3-[2-methoxy-5-(2-methylbutan-2-yl)phenyl]-4-nitro-2,5-diphenyl-1,2-oxazolidine Openeye Name: 3-[5-(1,1-dimethylpropyl)-2-methoxy-phenyl]-4-nitro-2,5-diphenyl-isoxazolidine CAS Name: 3-[2-methoxy-5-(2-methylbutan-2-yl)phenyl]-4-nitro-2,5-diphenylisoxazolidine IUPAC Name: 3-[2-methoxy-5-(2-methylbutan-2-yl)phenyl]-4-nitro-2,5-diphenyl-1,2-oxazolidine Traditional Name: 3-(5-tert-amyl-2-methoxy-phenyl)-4-nitro-2,5-diphenyl-isoxazolidine Formula: C27H30N2O4 MolecularWeight: 446.5381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OC)C2C(C(ON2C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OC)C2C(C(ON2C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H30N2O4/c1-5-27(2,3)20-16-17-23(32-4)22(18-20)24-25(29(30)31)26(19-12-8-6-9-13-19)33-28(24)21-14-10-7-11-15-21/h6-18,24-26H,5H2,1-4H3