[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] 4-phenylbutanoate

Systemtic Name: [1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] 4-phenylbutanoate Openeye Name: [1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] 4-phenylbutanoate CAS Name: 4-phenylbutanoic acid [1-(2,4-dichlorophenyl)-2-(1-imidazolyl)ethyl] ester IUPAC Name: [1-(2,4-dichlorophenyl)-2-imidazol-1-ylethyl] 4-phenylbutanoate Traditional Name: 4-phenylbutyric acid [1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] ester Formula: C21H20Cl2N2O2 MolecularWeight: 403.3017

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(=O)OC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCCC(=O)OC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H20Cl2N2O2/c22-17-9-10-18(19(23)13-17)20(14-25-12-11-24-15-25)27-21(26)8-4-7-16-5-2-1-3-6-16/h1-3,5-6,9-13,15,20H,4,7-8,14H2