(3-bromophenyl)methyl 5-(4-nitrophenyl)furan-2-carboxylate

Systemtic Name: (3-bromophenyl)methyl 5-(4-nitrophenyl)furan-2-carboxylate Openeye Name: (3-bromophenyl)methyl 5-(4-nitrophenyl)furan-2-carboxylate CAS Name: 5-(4-nitrophenyl)-2-furancarboxylic acid (3-bromophenyl)methyl ester IUPAC Name: (3-bromophenyl)methyl 5-(4-nitrophenyl)furan-2-carboxylate Traditional Name: 5-(4-nitrophenyl)furan-2-carboxylic acid (3-bromobenzyl) ester Formula: C18H12BrNO5 MolecularWeight: 402.19558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)COC(=O)C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)COC(=O)C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H12BrNO5/c19-14-3-1-2-12(10-14)11-24-18(21)17-9-8-16(25-17)13-4-6-15(7-5-13)20(22)23/h1-10H,11H2