[1,2-bis(2,4-dichlorophenyl)-3-imidazol-1-yl-propan-2-yl] nitrate

Systemtic Name: [1,2-bis(2,4-dichlorophenyl)-3-imidazol-1-yl-propan-2-yl] nitrate Openeye Name: [1-(2,4-dichlorophenyl)-1-[(2,4-dichlorophenyl)methyl]-2-imidazol-1-yl-ethyl] nitrate CAS Name: nitric acid [1,2-bis(2,4-dichlorophenyl)-3-(1-imidazolyl)propan-2-yl] ester IUPAC Name: [1,2-bis(2,4-dichlorophenyl)-3-imidazol-1-ylpropan-2-yl] nitrate Traditional Name: nitric acid [1-(2,4-dichlorobenzyl)-1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] ester Formula: C18H13Cl4N3O3 MolecularWeight: 461.12612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)CC(CN2C=CN=C2)(C3=C(C=C(C=C3)Cl)Cl)O[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)CC(CN2C=CN=C2)(C3=C(C=C(C=C3)Cl)Cl)O[N+](=O)[O-]

InChI

InChI=1S/C18H13Cl4N3O3/c19-13-2-1-12(16(21)7-13)9-18(28-25(26)27,10-24-6-5-23-11-24)15-4-3-14(20)8-17(15)22/h1-8,11H,9-10H2