[2-(2-nitroprop-1-enyl)phenyl] 4-bromanylbenzoate

Systemtic Name: [2-(2-nitroprop-1-enyl)phenyl] 4-bromanylbenzoate Openeye Name: [2-(2-nitroprop-1-enyl)phenyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-(2-nitroprop-1-enyl)phenyl] ester IUPAC Name: [2-(2-nitroprop-1-enyl)phenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(2-nitroprop-1-enyl)phenyl] ester Formula: C16H12BrNO4 MolecularWeight: 362.17478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CC(=CC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H12BrNO4/c1-11(18(20)21)10-13-4-2-3-5-15(13)22-16(19)12-6-8-14(17)9-7-12/h2-10H,1H3