ethyl 2-(2-nitro-4-phenyl-phenyl)-2-oxidanyl-pentanoate

Systemtic Name: ethyl 2-(2-nitro-4-phenyl-phenyl)-2-oxidanyl-pentanoate Openeye Name: ethyl 2-hydroxy-2-(2-nitro-4-phenyl-phenyl)pentanoate CAS Name: 2-hydroxy-2-(2-nitro-4-phenylphenyl)pentanoic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-2-(2-nitro-4-phenylphenyl)pentanoate Traditional Name: 2-hydroxy-2-(2-nitro-4-phenyl-phenyl)valeric acid ethyl ester Formula: C19H21NO5 MolecularWeight: 343.37374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C=C(C=C1)C2=CC=CC=C2)[N+](=O)[O-])(C(=O)OCC)O

Isomeric SMILES

CCCC(C1=C(C=C(C=C1)C2=CC=CC=C2)[N+](=O)[O-])(C(=O)OCC)O

InChI

InChI=1S/C19H21NO5/c1-3-12-19(22,18(21)25-4-2)16-11-10-15(13-17(16)20(23)24)14-8-6-5-7-9-14/h5-11,13,22H,3-4,12H2,1-2H3