(4-bromanylnaphthalen-1-yl) 4-methoxy-3-nitro-benzoate

Systemtic Name: (4-bromanylnaphthalen-1-yl) 4-methoxy-3-nitro-benzoate Openeye Name: (4-bromo-1-naphthyl) 4-methoxy-3-nitro-benzoate CAS Name: 4-methoxy-3-nitrobenzoic acid (4-bromo-1-naphthalenyl) ester IUPAC Name: (4-bromonaphthalen-1-yl) 4-methoxy-3-nitrobenzoate Traditional Name: 4-methoxy-3-nitro-benzoic acid (4-bromo-1-naphthyl) ester Formula: C18H12BrNO5 MolecularWeight: 402.19558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC2=CC=C(C3=CC=CC=C32)Br)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC2=CC=C(C3=CC=CC=C32)Br)[N+](=O)[O-]

InChI

InChI=1S/C18H12BrNO5/c1-24-17-8-6-11(10-15(17)20(22)23)18(21)25-16-9-7-14(19)12-4-2-3-5-13(12)16/h2-10H,1H3