[2-butanoyloxy-3-nitro-4-(4-phenylbutanoyl)phenyl] butanoate

Systemtic Name: [2-butanoyloxy-3-nitro-4-(4-phenylbutanoyl)phenyl] butanoate Openeye Name: [2-butanoyloxy-3-nitro-4-(4-phenylbutanoyl)phenyl] butanoate CAS Name: butanoic acid [3-nitro-2-(1-oxobutoxy)-4-(1-oxo-4-phenylbutyl)phenyl] ester IUPAC Name: [2-butanoyloxy-3-nitro-4-(4-phenylbutanoyl)phenyl] butanoate Traditional Name: butyric acid [2-butyryloxy-3-nitro-4-(4-phenylbutanoyl)phenyl] ester Formula: C24H27NO7 MolecularWeight: 441.47368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C(=C(C=C1)C(=O)CCCC2=CC=CC=C2)[N+](=O)[O-])OC(=O)CCC

Isomeric SMILES

CCCC(=O)OC1=C(C(=C(C=C1)C(=O)CCCC2=CC=CC=C2)[N+](=O)[O-])OC(=O)CCC

InChI

InChI=1S/C24H27NO7/c1-3-9-21(27)31-20-16-15-18(19(26)14-8-13-17-11-6-5-7-12-17)23(25(29)30)24(20)32-22(28)10-4-2/h5-7,11-12,15-16H,3-4,8-10,13-14H2,1-2H3