(4-nitrophenyl) 3-bromanyl-4-butoxy-benzoate

Systemtic Name: (4-nitrophenyl) 3-bromanyl-4-butoxy-benzoate Openeye Name: (4-nitrophenyl) 3-bromo-4-butoxy-benzoate CAS Name: 3-bromo-4-butoxybenzoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 3-bromo-4-butoxybenzoate Traditional Name: 3-bromo-4-butoxy-benzoic acid (4-nitrophenyl) ester Formula: C17H16BrNO5 MolecularWeight: 394.21664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C17H16BrNO5/c1-2-3-10-23-16-9-4-12(11-15(16)18)17(20)24-14-7-5-13(6-8-14)19(21)22/h4-9,11H,2-3,10H2,1H3